data_1lc2_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 1lc2 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 CA-C-O 118.735 -1.036 . . . . 10.0 110.708 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -133.76 161.38 34.86 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.256 1.206 . . . . 10.0 114.256 -152.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.7 m -68.35 -41.49 83.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 122.709 0.403 . . . . 10.0 111.977 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 mp0 -60.76 -49.26 78.22 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.843 1.257 . . . . 10.0 110.26 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.422 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 8.8 mmpt? -62.71 -14.77 47.99 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.687 1.195 . . . . 10.0 113.095 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -104.79 -45.34 1.41 Allowed Glycine 0 C--N 1.339 0.704 0 CA-C-N 119.703 1.138 . . . . 10.0 112.46 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -34.69 72.3 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.709 1.754 . . . . 10.0 112.443 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -62.19 -28.67 69.83 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.832 1.253 . . . . 10.0 114.259 177.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -98.42 -32.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.139 0.976 . . . . 10.0 110.684 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.464 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 t80 -57.82 -54.32 48.25 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 121.823 -0.548 . . . . 10.0 110.935 169.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.5 t -66.01 -11.62 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -90.25 -56.04 3.37 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.721 1.208 . . . . 10.0 111.325 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -125.59 7.76 7.6 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 116.238 1.94 . . . . 10.0 116.238 -168.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.464 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 33.7 m -110.76 -49.01 3.07 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.295 1.038 . . . . 10.0 110.648 166.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.53 53.07 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.919 1.081 . . . . 10.0 113.919 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -13.77 39.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.827 2.451 . . . . 10.0 113.564 169.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.6 m -141.15 -33.64 0.52 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.229 1.812 . . . . 10.0 112.237 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -120.19 66.6 0.83 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 128.954 2.902 . . . . 10.0 109.922 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -68.19 127.49 33.11 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.356 -1.465 . . . . 10.0 108.178 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.42 -66.39 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 124.632 1.173 . . . . 10.0 110.595 -176.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.53 -31.32 65.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.184 0.902 . . . . 10.0 112.698 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.17 -6.23 59.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.55 1.14 . . . . 10.0 113.785 178.855 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.177 0 C-N-CA 126.596 2.046 . . . . 10.0 110.871 -163.459 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 N--CA 1.483 1.196 0 N-CA-C 113.398 0.888 . . . . 10.0 113.398 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.66 167.35 24.83 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 157.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.02 127.9 16.8 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.854 2.369 . . . . 10.0 110.805 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.99 127.61 32.19 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.224 -0.923 . . . . 10.0 110.45 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.7 81.5 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.858 1.263 . . . . 10.0 111.862 -170.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.68 73.14 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.111 2.164 . . . . 10.0 109.962 163.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.78 -63.08 0.32 Allowed Glycine 0 CA--C 1.535 1.312 0 C-N-CA 127.718 2.58 . . . . 10.0 114.065 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 68.29 -48.6 0.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.449 2.7 . . . . 10.0 116.022 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -63.67 113.44 3.36 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.595 1.089 . . . . 10.0 111.095 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.48 0.0 82.37 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.954 1.264 . . . . 10.0 113.947 -175.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.8 mtp85 -86.89 -127.93 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.901 1.281 . . . . 10.0 110.802 172.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -154.35 173.41 16.23 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.188 1.795 . . . . 10.0 110.99 -172.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 t -95.8 -48.16 5.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.967 0.907 . . . . 10.0 113.344 -174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.05 61.66 2.99 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.528 1.537 . . . . 10.0 111.609 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -130.15 -18.96 3.23 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.088 1.755 . . . . 10.0 113.347 -161.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.32 151.74 86.5 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 124.464 1.105 . . . . 10.0 112.572 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -76.01 -160.19 0.11 Allowed 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 124.277 3.318 . . . . 10.0 110.839 167.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.23 86.96 0.01 OUTLIER Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.715 2.103 . . . . 10.0 115.327 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -144.05 -179.43 6.49 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.329 2.252 . . . . 10.0 109.559 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.6 m -156.86 142.9 17.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 119.741 -1.849 . . . . 10.0 109.774 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.55 -85.72 0.06 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.886 0.874 . . . . 10.0 112.806 -163.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 t -144.93 173.85 11.52 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.639 2.776 . . . . 10.0 108.751 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.05 -37.33 58.42 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.953 -1.092 . . . . 10.0 112.322 155.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.1 -61.82 1.99 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.022 1.329 . . . . 10.0 112.776 -160.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -51.71 -61.82 2.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.963 0.905 . . . . 10.0 111.906 -171.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -56.08 26.79 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.418 1.087 . . . . 10.0 111.847 -176.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -44.2 82.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.176 -0.916 . . . . 10.0 111.737 -171.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.59 -45.25 38.7 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.171 -0.919 . . . . 10.0 111.708 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 55.37 -179.24 0.33 Allowed Glycine 0 CA--C 1.54 1.621 0 N-CA-C 116.696 1.438 . . . . 10.0 116.696 -176.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.66 -6.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 128.328 2.651 . . . . 10.0 113.701 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.0 m 55.84 115.95 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.846 2.059 . . . . 10.0 113.038 -159.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -73.09 126.3 29.67 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.295 -0.878 . . . . 10.0 111.658 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -165.34 176.03 8.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.272 2.229 . . . . 10.0 110.184 -174.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.32 -30.06 64.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.248 1.419 . . . . 10.0 114.33 -176.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -71.96 -71.65 0.27 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.853 0.861 . . . . 10.0 110.746 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.5 p -59.61 -38.15 80.49 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 125.88 1.672 . . . . 10.0 112.844 -165.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.28 -29.44 60.11 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.289 0.949 . . . . 10.0 113.134 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 ttm -69.6 -48.75 59.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 171.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -57.29 -45.0 84.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.275 1.43 . . . . 10.0 110.546 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -61.48 -60.04 4.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.619 1.568 . . . . 10.0 112.945 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -56.63 -32.23 65.12 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.783 1.629 . . . . 10.0 114.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.21 -24.61 63.13 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.909 1.448 . . . . 10.0 114.909 174.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -163.3 91.71 1.17 Allowed Pre-proline 0 CA--C 1.552 1.035 0 CA-C-N 119.759 1.163 . . . . 10.0 112.602 162.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.98 -37.99 2.48 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.406 2.071 . . . . 10.0 112.544 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -59.06 -43.12 91.69 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.878 1.671 . . . . 10.0 112.444 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -75.0 -41.06 60.24 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 118.982 -0.532 . . . . 10.0 111.434 175.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -69.04 -36.72 78.03 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.821 1.415 . . . . 10.0 114.821 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -131.18 127.82 21.99 Favored Pre-proline 0 N--CA 1.475 0.788 0 CA-C-N 119.169 0.895 . . . . 10.0 111.035 172.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.15 93.8 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.912 3.075 . . . . 10.0 113.315 -153.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 110.97 0.0 28.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.574 1.083 . . . . 10.0 114.299 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.5 m -60.15 106.58 0.53 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.68 1.24 . . . . 10.0 111.206 172.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -64.36 -56.67 12.8 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.211 -0.9 . . . . 10.0 112.157 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.0 ttt 25.31 84.2 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.814 2.445 . . . . 10.0 114.115 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 30.8 mt -73.57 77.33 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.937 1.295 . . . . 10.0 110.829 -172.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -163.34 -45.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.15 1.78 . . . . 10.0 111.62 170.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.58 0.96 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 120.743 3.608 . . . . 10.0 120.743 172.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.72 170.71 40.65 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 125.516 1.531 . . . . 10.0 111.176 169.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -143.18 63.12 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 118.809 1.305 . . . . 10.0 112.861 -164.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 62.29 -56.87 0.14 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 128.22 2.608 . . . . 10.0 116.096 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -163.47 156.25 18.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.6 2.36 . . . . 10.0 109.096 -169.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -7.7 11.79 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 10.0 115.301 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -54.1 8.8 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.446 1.499 . . . . 10.0 110.751 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -54.28 -35.3 62.42 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.306 1.042 . . . . 10.0 110.95 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -56.8 -65.19 0.66 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.583 1.953 . . . . 10.0 112.107 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -31.56 72.47 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.997 0.74 . . . . 10.0 112.997 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -57.55 -47.42 82.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.692 0.797 . . . . 10.0 110.61 170.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.82 -46.43 84.7 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 175.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.1 mm -56.48 -52.53 51.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.82 60.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 117.64 -1.171 . . . . 10.0 113.669 -174.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.4 -64.87 0.76 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.374 1.869 . . . . 10.0 110.805 162.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.6 mt -60.17 -30.28 69.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.278 0.631 . . . . 10.0 112.684 -174.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -59.3 -21.93 60.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.872 1.064 . . . . 10.0 113.872 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -79.27 -45.19 20.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.694 -1.146 . . . . 10.0 110.809 168.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.19 1.28 0.19 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.304 1.594 . . . . 10.0 115.304 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.6 p -110.37 11.84 23.21 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.859 1.663 . . . . 10.0 114.348 168.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -153.57 -34.59 0.11 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.534 1.061 . . . . 10.0 113.815 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 . . . . . 0 C--O 1.259 1.563 0 C-N-CA 125.161 1.385 . . . . 10.0 110.9 149.669 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.896 0 CA-C-O 118.416 -1.213 . . . . 10.0 111.007 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -109.21 145.51 35.74 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.905 0.852 . . . . 10.0 112.467 -167.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.12 -41.43 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 118.413 -0.803 . . . . 10.0 112.005 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -51.79 -57.03 10.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.911 1.284 . . . . 10.0 112.611 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -57.06 -25.5 58.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.006 1.323 . . . . 10.0 111.722 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -86.94 -50.37 3.73 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.406 1.479 . . . . 10.0 111.841 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.5 pttp -63.13 -43.21 99.01 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.76 1.28 . . . . 10.0 111.57 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -40.83 97.7 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.054 -0.974 . . . . 10.0 111.728 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.85 -25.29 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 119.384 0.993 . . . . 10.0 112.774 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -55.96 -50.75 69.94 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.249 -0.907 . . . . 10.0 109.681 163.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.04 29.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 N-CA-C 113.415 0.894 . . . . 10.0 113.415 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -36.57 5.36 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 119.265 -2.147 . . . . 10.0 112.272 164.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.99 -55.59 1.37 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.631 0.772 . . . . 10.0 112.921 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -52.15 -49.49 63.66 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 125.256 1.422 . . . . 10.0 112.802 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.7 -22.87 62.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.925 1.083 . . . . 10.0 113.925 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -16.16 51.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.92 0.888 . . . . 10.0 112.356 173.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 82.1 m -141.34 0.51 1.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.864 1.266 . . . . 10.0 114.228 -174.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -150.47 12.17 0.71 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.593 1.331 . . . . 10.0 114.593 -172.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 t -42.76 104.9 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.7 1.741 . . . . 10.0 115.7 -165.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.8 p -142.29 -8.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 127.339 2.256 . . . . 10.0 112.559 -171.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.73 -18.82 13.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.124 1.369 . . . . 10.0 112.033 165.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -152.76 145.98 24.72 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.395 1.478 . . . . 10.0 110.981 155.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.446 0 C-N-CA 125.354 1.454 . . . . 10.0 115.559 176.8 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 116.676 2.102 . . . . 10.0 116.676 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.57 168.86 14.98 Favored Glycine 0 CA--C 1.543 1.807 0 CA-C-N 120.582 1.537 . . . . 10.0 112.918 171.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HA ' ' CD2' ' A' ' 46' ' ' PHE . 20.9 Cg_endo -71.55 -8.09 22.54 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 124.691 3.594 . . . . 10.0 118.61 -167.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.57 142.16 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.741 1.616 . . . . 10.0 113.87 -154.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -85.51 70.39 10.76 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.052 -1.03 . . . . 10.0 110.157 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.27 114.53 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.316 1.446 . . . . 10.0 110.17 165.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 9.14 76.36 0.01 OUTLIER Glycine 0 N--CA 1.476 1.308 0 C-N-CA 129.044 3.212 . . . . 10.0 115.9 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -30.6 65.3 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 116.189 1.922 . . . . 10.0 116.189 -156.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -85.87 93.67 8.97 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.965 0.802 . . . . 10.0 111.607 -159.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.08 -13.91 6.31 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 127.051 2.262 . . . . 10.0 114.282 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -85.81 157.98 20.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.733 1.266 . . . . 10.0 113.416 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -77.01 169.76 17.75 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.659 1.184 . . . . 10.0 112.023 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.2 t -50.91 155.54 1.17 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.065 2.146 . . . . 10.0 115.927 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 59.11 31.06 68.11 Favored Glycine 0 CA--C 1.539 1.546 0 N-CA-C 118.458 2.143 . . . . 10.0 118.458 155.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -83.59 7.0 18.62 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 120.241 2.021 . . . . 10.0 115.363 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 133.91 93.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.623 1.102 . . . . 10.0 112.72 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.12 87.38 0.73 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.646 2.23 . . . . 10.0 113.041 -172.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.13 -1.7 88.5 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.947 1.736 . . . . 10.0 115.823 167.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.428 ' CD2' ' HA ' ' A' ' 30' ' ' PRO . 1.0 OUTLIER -66.39 137.08 56.62 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.754 1.277 . . . . 10.0 112.067 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 m -72.61 83.08 1.13 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.716 1.607 . . . . 10.0 112.652 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.28 175.33 9.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.639 1.176 . . . . 10.0 112.917 168.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.1 p -76.68 -175.36 3.36 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.695 1.598 . . . . 10.0 113.572 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -66.79 177.09 1.75 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.208 1.403 . . . . 10.0 113.23 152.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.67 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 129.352 3.061 . . . . 10.0 116.029 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -47.61 -59.93 2.91 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.891 1.678 . . . . 10.0 112.286 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -27.0 68.97 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.545 -0.722 . . . . 10.0 112.482 -176.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -26.8 63.86 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 117.209 2.3 . . . . 10.0 117.209 171.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -163.29 -1.31 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 116.648 2.092 . . . . 10.0 116.648 -155.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -67.85 163.34 47.47 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.63 1.586 . . . . 10.0 114.107 -177.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -66.31 173.89 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.89 2.476 . . . . 10.0 114.206 -176.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 m -69.57 124.33 23.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.024 0.93 . . . . 10.0 110.232 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -75.38 124.64 27.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.578 0.751 . . . . 10.0 111.716 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.8 pttt -171.3 -176.73 1.95 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.562 2.345 . . . . 10.0 109.5 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.498 ' CD ' ' HZ2' ' A' ' 99' ' ' LYS . 0.9 OUTLIER -44.33 -55.07 5.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.901 0.88 . . . . 10.0 112.299 174.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.21 12.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.948 2.499 . . . . 10.0 115.783 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 63.5 p -157.67 -34.8 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.246 1.018 . . . . 10.0 111.356 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -33.27 60.69 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.807 1.185 . . . . 10.0 112.761 169.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 70.3 mtm -66.28 -48.15 71.35 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.979 1.263 . . . . 10.0 110.521 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -63.89 -37.79 88.71 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 122.652 0.381 . . . . 10.0 110.397 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -65.01 -60.63 2.83 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-O 119.035 -0.507 . . . . 10.0 111.927 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -29.92 70.31 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 120.196 1.362 . . . . 10.0 112.444 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -69.08 -31.24 69.84 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 170.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.84 76.79 1.67 Allowed Pre-proline 0 CA--C 1.553 1.078 0 CA-C-N 120.035 1.289 . . . . 10.0 113.163 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.01 -44.23 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.928 1.752 . . . . 10.0 111.942 -159.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -68.03 -30.65 69.93 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 126.427 1.891 . . . . 10.0 112.7 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -76.26 -40.24 52.36 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.737 1.215 . . . . 10.0 112.352 168.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -63.97 -45.88 87.1 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.748 0.704 . . . . 10.0 112.45 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.99 129.39 10.52 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.796 1.638 . . . . 10.0 110.414 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.62 179.42 4.7 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.806 2.337 . . . . 10.0 112.656 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.2 -33.87 1.1 Allowed Glycine 0 CA--C 1.529 0.943 0 C-N-CA 126.216 1.865 . . . . 10.0 114.156 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 90.3 m -60.56 83.26 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.997 1.719 . . . . 10.0 113.957 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.22 31.96 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.477 2.711 . . . . 10.0 114.123 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.7 ttt -64.39 108.78 1.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.058 1.743 . . . . 10.0 111.219 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 mt -76.5 67.33 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.856 1.262 . . . . 10.0 110.481 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -163.43 -35.9 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.693 1.368 . . . . 10.0 114.693 172.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.22 -3.96 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 121.154 3.761 . . . . 10.0 121.154 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.83 -147.72 5.08 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-N 120.868 1.667 . . . . 10.0 112.148 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tt -144.48 171.86 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.937 0.895 . . . . 10.0 108.89 158.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -75.01 -7.31 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.618 1.34 . . . . 10.0 114.618 -160.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.59 -67.37 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.882 1.273 . . . . 10.0 110.666 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.38 -53.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 127.577 2.351 . . . . 10.0 112.634 162.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.7 m -50.92 -33.62 25.07 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.357 1.863 . . . . 10.0 112.118 -168.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -45.15 -50.09 11.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.254 1.422 . . . . 10.0 112.202 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.353 0.0 OUTLIER -77.76 -10.84 59.75 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.112 1.523 . . . . 10.0 115.112 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -75.02 -40.72 60.36 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.163 0.892 . . . . 10.0 110.488 162.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.22 -40.28 78.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.417 1.087 . . . . 10.0 112.092 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 15.9 tp -57.84 -46.23 85.08 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.579 1.552 . . . . 10.0 113.122 178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 mm -59.07 -46.42 91.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 C-N-CA 124.176 0.99 . . . . 10.0 109.786 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -43.36 98.75 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.146 0.43 . . . . 10.0 111.931 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.6 -56.64 19.6 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.824 0.85 . . . . 10.0 111.974 170.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.15 -26.55 68.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.778 1.172 . . . . 10.0 112.955 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.498 ' HZ2' ' CD ' ' A' ' 61' ' ' GLU . 32.1 tptt -60.01 -12.2 7.54 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.402 1.481 . . . . 10.0 113.382 167.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -131.62 36.04 3.77 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.206 3.002 . . . . 10.0 111.979 166.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.72 30.69 4.34 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.4 1.48 . . . . 10.0 110.052 154.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -142.36 7.73 1.76 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.895 2.078 . . . . 10.0 115.112 -174.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -153.05 -73.24 0.14 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.454 2.302 . . . . 10.0 108.242 177.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.258 1.529 0 CA-C-O 117.133 -1.413 . . . . 10.0 109.083 124.222 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.96 0 CA-C-O 119.112 -0.826 . . . . 10.0 111.407 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -93.99 -173.16 3.04 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.399 1.88 . . . . 10.0 110.853 176.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.0 t -78.78 -32.9 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 120.312 -1.492 . . . . 10.0 111.166 143.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -36.08 79.1 Favored 'General case' 0 CA--C 1.514 -0.425 0 C-N-CA 128.063 2.545 . . . . 10.0 114.224 -159.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -73.36 -25.47 60.61 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.44 -54.5 5.51 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 126.167 1.842 . . . . 10.0 110.289 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -23.39 67.4 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.485 1.291 . . . . 10.0 114.485 178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -76.49 -53.49 8.03 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 120.143 1.338 . . . . 10.0 113.414 164.283 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.32 -31.33 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.438 1.017 . . . . 10.0 112.555 -170.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.56 -51.31 69.06 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.175 0.443 . . . . 10.0 109.999 172.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.2 -9.1 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 112.868 0.692 . . . . 10.0 112.868 -177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -96.11 -47.68 5.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.374 1.47 . . . . 10.0 111.562 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -119.62 -8.53 9.94 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.428 1.64 . . . . 10.0 115.428 -170.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 34.5 m -113.92 -45.16 3.1 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.813 1.245 . . . . 10.0 111.325 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.21 -25.04 61.13 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 176.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.05 -14.39 0.41 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.415 2.686 . . . . 10.0 114.096 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -141.23 -34.7 0.48 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.609 1.564 . . . . 10.0 112.053 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -103.58 -9.68 19.05 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.949 1.463 . . . . 10.0 114.949 -173.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.419 HG21 ' H ' ' A' ' 20' ' ' VAL 0.359 6.8 t 38.58 -88.93 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.305 2.642 . . . . 10.0 115.694 -166.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.419 ' H ' HG21 ' A' ' 19' ' ' THR 0.3 8.7 p 37.48 48.51 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 128.965 2.906 . . . . 10.0 115.986 174.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.44 -41.11 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.274 1.03 . . . . 10.0 112.784 170.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -154.14 -40.99 0.09 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 130.431 3.492 . . . . 10.0 110.786 -173.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.128 0 C-N-CA 127.064 2.269 . . . . 10.0 112.302 177.935 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.9 m . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -133.72 163.82 24.42 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.564 2.031 . . . . 10.0 111.754 162.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.72 161.56 21.6 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.261 2.641 . . . . 10.0 112.075 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.534 HD22 ' CD2' ' A' ' 33' ' ' HIS . 8.9 p-10 -65.29 11.25 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 130.267 3.427 . . . . 10.0 115.944 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt 50.52 -33.25 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.952 1 C-N-CA 132.075 4.15 . . . . 10.0 118.181 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.534 ' CD2' HD22 ' A' ' 31' ' ' ASN 0.276 0.0 OUTLIER 34.5 72.58 0.09 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.631 3.172 . . . . 10.0 114.227 178.789 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.92 -34.49 0.74 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 126.288 1.899 . . . . 10.0 114.667 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tp 60.51 -68.08 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.814 3.246 . . . . 10.0 116.387 170.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -65.67 114.51 5.03 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.645 1.578 . . . . 10.0 110.82 -171.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.68 1.83 88.94 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 118.654 -1.081 . . . . 10.0 114.484 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.482 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.6 OUTLIER -78.81 -96.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.887 1.343 . . . . 10.0 108.469 169.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -156.64 175.18 14.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.752 2.421 . . . . 10.0 109.781 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.7 m -109.09 95.37 5.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.871 -1.9 . . . . 10.0 105.871 153.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.27 -66.3 0.09 OUTLIER Glycine 0 CA--C 1.528 0.858 0 CA-C-O 122.022 0.79 . . . . 10.0 113.069 -163.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -64.77 133.91 53.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.679 1.992 . . . . 10.0 113.514 -172.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.66 150.76 10.48 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 128.47 2.708 . . . . 10.0 107.317 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.57 66.27 8.55 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.734 2.956 . . . . 10.0 111.817 -176.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.86 71.59 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.295 0.95 . . . . 10.0 115.219 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.11 119.59 10.46 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.08 1.352 . . . . 10.0 111.204 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.0 m -70.92 82.98 0.66 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.291 1.837 . . . . 10.0 113.174 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.541 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -86.17 -173.25 4.47 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.795 1.638 . . . . 10.0 113.896 170.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.3 t -62.57 172.49 1.57 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 126.188 1.795 . . . . 10.0 111.581 168.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -75.47 -80.44 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 120.417 -1.427 . . . . 10.0 111.511 154.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 69.42 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 131.365 3.866 . . . . 10.0 116.498 -165.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -161.68 -70.89 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.363 2.265 . . . . 10.0 107.601 169.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.541 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -55.16 -37.44 66.99 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.11 2.564 . . . . 10.0 111.197 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.74 -37.6 84.82 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.54 1.136 . . . . 10.0 113.192 176.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -76.91 -50.09 14.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.076 0.853 . . . . 10.0 112.011 170.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.34 82.16 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.896 1.236 . . . . 10.0 113.394 -175.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.5 pp -66.23 -16.95 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.067 -1.255 . . . . 10.0 113.618 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.446 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 24.3 m 55.77 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 129.378 3.071 . . . . 10.0 113.393 -169.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.2 m95 -77.18 146.78 36.84 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 120.887 -1.133 . . . . 10.0 111.421 168.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 58' ' ' THR . 7.2 ptpt -163.64 -51.46 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.351 1.46 . . . . 10.0 110.939 -170.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 171.87 -55.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 130.338 3.455 . . . . 10.0 109.44 164.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -44.72 -54.9 5.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.148 2.179 . . . . 10.0 112.48 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 66.9 p -65.52 -28.25 69.04 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 125.213 1.405 . . . . 10.0 113.209 -173.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -28.5 59.99 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.375 1.07 . . . . 10.0 112.337 173.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.4 mtm -69.88 -47.5 62.37 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-O 118.738 -0.649 . . . . 10.0 110.793 172.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -61.83 -43.2 99.33 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.153 0.502 . . . . 10.0 110.438 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -57.97 -67.41 0.34 Allowed 'General case' 0 C--O 1.221 -0.441 0 CA-C-O 117.553 -1.213 . . . . 10.0 111.924 176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 mt -65.87 -19.55 65.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 121.439 1.927 . . . . 10.0 114.816 -173.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -73.75 -24.7 59.91 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.813 1.188 . . . . 10.0 113.881 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.78 64.84 1.55 Allowed Pre-proline 0 CA--C 1.559 1.311 0 CA-C-N 120.124 1.329 . . . . 10.0 112.999 -177.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -72.32 -46.58 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.183 1.922 . . . . 10.0 113.014 -159.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -26.47 68.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.552 1.141 . . . . 10.0 112.697 176.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -76.16 -48.07 21.87 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.728 0.811 . . . . 10.0 111.291 169.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.65 -38.1 88.38 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.561 0.948 . . . . 10.0 113.561 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 pt -142.81 105.58 5.33 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.819 1.248 . . . . 10.0 109.644 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.16 -24.58 44.29 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.484 2.789 . . . . 10.0 115.321 -155.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.33 -9.53 81.7 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.586 -1.119 . . . . 10.0 114.385 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.1 m -76.88 75.75 3.48 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.916 1.858 . . . . 10.0 112.442 -172.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -68.97 27.11 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.714 2.006 . . . . 10.0 114.609 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.8 ttp -50.67 117.68 2.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.31 2.244 . . . . 10.0 111.83 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.0 mt -76.48 68.3 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.511 1.524 . . . . 10.0 109.638 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -163.85 -32.28 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.466 1.506 . . . . 10.0 113.533 174.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.7 -24.06 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 120.145 3.387 . . . . 10.0 120.145 -173.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 173.02 167.2 32.6 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 122.131 2.242 . . . . 10.0 113.844 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 tt -93.32 160.71 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.868 0.867 . . . . 10.0 111.909 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.07 -31.49 65.26 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 116.024 1.861 . . . . 10.0 116.024 -167.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -164.34 148.61 9.68 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.724 1.61 . . . . 10.0 109.766 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -20.62 65.28 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.326 1.232 . . . . 10.0 114.326 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.0 m -59.26 -44.25 92.42 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.08 -1.013 . . . . 10.0 111.254 171.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.03 -35.83 82.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.297 1.439 . . . . 10.0 111.045 177.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -60.08 -47.94 83.78 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.316 1.446 . . . . 10.0 111.239 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -59.31 -51.32 70.43 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.626 0.77 . . . . 10.0 111.485 170.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -43.71 81.39 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.826 1.65 . . . . 10.0 112.683 -174.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.6 -37.88 73.97 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.35 -48.75 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 118.639 0.654 . . . . 10.0 109.441 173.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.04 -49.78 76.58 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.369 0.668 . . . . 10.0 112.038 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.05 -59.16 5.14 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.091 0.956 . . . . 10.0 111.91 172.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.45 -35.62 79.86 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.406 1.003 . . . . 10.0 112.201 -176.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.74 -15.93 63.3 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.462 1.028 . . . . 10.0 112.976 177.129 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -109.84 20.56 17.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.059 1.343 . . . . 10.0 114.248 165.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.56 -1.18 14.15 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.596 1.558 . . . . 10.0 112.561 164.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.47 -4.36 57.33 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.798 -1.189 . . . . 10.0 113.053 173.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -154.9 3.34 0.21 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.104 1.362 . . . . 10.0 113.973 -159.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 127.755 2.422 . . . . 10.0 107.809 -173.232 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.478 ' H2 ' ' CG ' ' A' ' 93' ' ' ASP . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 110.623 -0.991 . . . . 10.0 110.623 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -136.76 135.94 38.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.537 1.535 . . . . 10.0 109.198 -161.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.9 t -54.33 -49.95 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.94 0.896 . . . . 10.0 111.08 -172.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.96 -56.31 19.0 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.674 1.59 . . . . 10.0 112.976 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -61.01 -24.87 66.49 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 112.875 0.695 . . . . 10.0 112.875 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.48 -50.58 6.53 Favored Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.042 -1.223 . . . . 10.0 110.042 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -63.32 -43.16 98.59 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 118.911 1.355 . . . . 10.0 113.274 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -39.21 92.39 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.134 0.879 . . . . 10.0 112.75 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -79.29 -36.07 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.792 0.724 . . . . 10.0 111.719 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -56.21 -48.85 75.63 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.997 0.919 . . . . 10.0 110.683 171.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.61 -15.58 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 113.609 0.966 . . . . 10.0 113.609 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -96.08 -33.72 11.99 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 123.946 0.898 . . . . 10.0 113.42 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.9 1.84 2.8 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 116.109 1.892 . . . . 10.0 116.109 -172.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -122.12 -49.2 2.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.013 1.725 . . . . 10.0 110.851 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.72 66.71 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.545 0.943 . . . . 10.0 113.545 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -46.07 -47.92 17.05 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.911 1.684 . . . . 10.0 112.057 171.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 98.5 m -89.22 -44.39 10.31 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 10.0 113.408 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.415 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 88.9 m-70 -105.96 -10.02 16.8 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.607 2.077 . . . . 10.0 116.607 -162.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.308 11.1 t 37.42 -82.17 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 127.699 2.4 . . . . 10.0 116.732 -164.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.267 7.5 p 46.25 -51.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 131.35 3.86 . . . . 10.0 116.055 -161.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -20.11 0.1 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 131.487 3.915 . . . . 10.0 117.642 -168.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.4 pttm -152.49 22.57 0.62 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.844 1.658 . . . . 10.0 111.546 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.163 0 CA-C-O 121.891 0.717 . . . . 10.0 111.862 -165.479 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 m . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 115.46 1.652 . . . . 10.0 115.46 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.03 136.3 12.92 Favored Glycine 0 CA--C 1.542 1.769 0 CA-C-N 120.748 1.613 . . . . 10.0 111.65 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 9.6 Cg_endo -59.66 1.57 0.39 Allowed 'Trans proline' 0 C--N 1.353 0.787 1 C-N-CA 127.2 5.266 . . . . 10.0 118.411 -173.218 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER 63.11 143.02 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.916 2.486 . . . . 10.0 114.12 -161.119 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.29 65.41 9.19 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.287 1.042 . . . . 10.0 110.913 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.81 163.58 1.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.048 1.339 . . . . 10.0 111.446 158.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.8 85.87 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.933 1.73 . . . . 10.0 116.267 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.18 -168.14 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.222 2.609 . . . . 10.0 113.215 169.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 55.02 35.28 24.33 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.819 2.448 . . . . 10.0 114.622 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 166.84 -19.64 0.09 OUTLIER Glycine 0 CA--C 1.531 1.075 0 N-CA-C 115.271 0.869 . . . . 10.0 115.271 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -74.58 -145.23 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.909 1.284 . . . . 10.0 110.994 164.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -151.85 -179.74 7.73 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.636 1.974 . . . . 10.0 109.072 171.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.2 p -59.8 158.32 10.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.448 1.118 . . . . 10.0 112.971 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.0 -8.24 78.75 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 116.96 1.544 . . . . 10.0 116.96 163.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -71.13 -7.12 44.4 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.396 1.998 . . . . 10.0 116.396 -167.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.45 134.87 96.13 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.445 1.475 . . . . 10.0 111.275 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -76.77 155.67 34.97 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.014 1.809 . . . . 10.0 111.774 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 21.99 68.01 0.02 OUTLIER Glycine 0 CA--C 1.536 1.363 0 C-N-CA 128.765 3.079 . . . . 10.0 116.67 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -147.62 -42.58 0.17 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.673 0.99 . . . . 10.0 113.673 -172.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 m 60.02 83.76 0.13 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.159 2.184 . . . . 10.0 114.049 170.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -115.46 115.5 26.64 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 126.063 1.745 . . . . 10.0 112.86 -172.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.5 t 50.18 175.87 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.187 2.195 . . . . 10.0 115.119 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -78.49 -69.66 0.55 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.0 1.72 . . . . 10.0 112.316 161.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.36 -30.31 68.29 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.668 1.587 . . . . 10.0 114.21 -157.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.98 -63.42 1.16 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 119.008 0.822 . . . . 10.0 110.668 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -52.13 -43.16 63.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 119.082 -0.485 . . . . 10.0 110.432 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.67 -32.04 73.38 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.622 2.082 . . . . 10.0 116.622 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -54.43 -35.34 62.85 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.816 1.644 . . . . 10.0 113.673 -170.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.26 -9.49 47.67 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.56 1.552 . . . . 10.0 115.646 168.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.8 pp -63.0 159.93 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 126.336 1.854 . . . . 10.0 112.619 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -9.6 58.5 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.415 1.486 . . . . 10.0 114.936 -169.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.5 m95 45.28 97.42 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.556 2.742 . . . . 10.0 114.012 -162.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -161.59 -178.83 6.84 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.168 1.387 . . . . 10.0 109.917 -169.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -61.21 -29.62 69.93 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.667 1.729 . . . . 10.0 115.667 -155.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.49 -51.15 31.01 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 122.299 2.318 . . . . 10.0 111.484 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.4 p -72.32 -40.53 67.4 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.274 1.429 . . . . 10.0 113.153 -174.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.26 -30.24 64.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.977 0.911 . . . . 10.0 111.88 174.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 36.8 ttm -67.81 -48.7 65.5 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.493 -0.765 . . . . 10.0 109.565 169.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -54.3 -44.75 72.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.876 0.762 . . . . 10.0 110.916 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -69.39 -55.95 8.87 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.401 -0.809 . . . . 10.0 112.659 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.51 -11.03 60.49 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.814 1.643 . . . . 10.0 114.379 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -84.72 -29.46 25.53 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 120.507 1.503 . . . . 10.0 112.854 163.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.5 75.61 1.81 Allowed Pre-proline 0 CA--C 1.558 1.267 0 CA-C-N 119.106 0.866 . . . . 10.0 113.002 -172.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -71.3 -56.77 0.11 Allowed 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.486 2.124 . . . . 10.0 112.824 -163.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -65.02 -17.54 64.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.028 1.331 . . . . 10.0 113.905 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -76.34 -49.5 16.7 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.265 1.426 . . . . 10.0 111.586 165.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -62.93 -34.35 77.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.421 0.897 . . . . 10.0 113.421 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.84 125.45 7.46 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.393 1.477 . . . . 10.0 110.66 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.85 169.01 21.34 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.636 2.224 . . . . 10.0 112.657 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.31 -104.46 1.28 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.458 -1.457 . . . . 10.0 109.458 -166.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.4 m 59.93 -39.67 0.09 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 129.217 3.007 . . . . 10.0 118.364 165.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 59.97 -57.59 0.07 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 128.237 2.615 . . . . 10.0 116.311 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt -3.7 87.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 129.824 3.25 . . . . 10.0 113.772 -168.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.416 ' H ' HD11 ' A' ' 81' ' ' ILE . 3.9 mp -77.23 70.4 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.82 1.648 . . . . 10.0 109.884 -166.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -163.01 -27.08 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.852 1.661 . . . . 10.0 113.02 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.86 -12.57 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 121.136 3.754 . . . . 10.0 121.136 172.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.34 -142.73 3.46 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 120.688 1.585 . . . . 10.0 111.808 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -144.71 165.12 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.805 0.842 . . . . 10.0 109.912 159.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -67.82 -21.33 65.22 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.852 1.797 . . . . 10.0 115.852 -167.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -163.07 140.68 7.84 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.416 1.486 . . . . 10.0 109.703 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -54.94 -41.79 71.49 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 -159.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -46.08 64.1 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.144 0.977 . . . . 10.0 111.159 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -58.03 -25.8 61.62 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.033 0.933 . . . . 10.0 112.305 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -29.05 59.85 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.853 0.861 . . . . 10.0 113.317 174.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -72.17 -47.19 52.66 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.592 1.157 . . . . 10.0 110.24 169.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.478 ' CG ' ' H2 ' ' A' ' 1' ' ' GLY . 3.2 m-20 -58.35 -39.41 79.44 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.647 1.179 . . . . 10.0 112.332 174.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.56 -48.45 79.31 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 168.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.7 mm -60.43 -45.14 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.078 0.854 . . . . 10.0 109.823 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.74 80.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.097 0.559 . . . . 10.0 112.453 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.7 -60.38 3.93 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.208 1.003 . . . . 10.0 112.075 174.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.27 -24.52 65.79 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -171.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -57.72 -55.02 40.25 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.884 0.765 . . . . 10.0 111.208 165.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -67.28 -33.19 74.78 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 117.853 -1.07 . . . . 10.0 113.505 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.12 -12.36 2.14 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.619 1.341 . . . . 10.0 114.619 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 p -76.63 -11.16 59.81 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.191 1.397 . . . . 10.0 114.209 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.26 9.45 0.42 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.048 1.339 . . . . 10.0 114.559 -168.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.973 2.909 . . . . 10.0 109.138 -174.054 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.427 0 CA-C-O 119.324 -0.709 . . . . 10.0 112.753 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.39 105.26 9.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 117.893 0.846 . . . . 10.0 109.671 -155.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.9 t -46.4 -48.98 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.57 1.548 . . . . 10.0 111.819 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -66.21 -34.7 78.62 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.096 1.358 . . . . 10.0 113.207 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -73.21 -31.64 64.29 Favored 'General case' 0 C--O 1.23 0.063 0 C-N-CA 123.803 0.841 . . . . 10.0 111.754 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.54 -42.14 56.06 Favored Glycine 0 C--O 1.226 -0.349 0 N-CA-C 109.588 -1.405 . . . . 10.0 109.588 -171.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -55.67 -48.16 75.51 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 171.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.65 66.83 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.685 0.994 . . . . 10.0 113.685 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.77 -40.18 76.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 119.658 1.117 . . . . 10.0 110.837 169.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.2 -55.17 30.54 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.709 0.686 . . . . 10.0 109.94 175.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.54 -8.83 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -96.63 -47.57 5.86 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.194 1.398 . . . . 10.0 111.567 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -117.58 -8.33 10.96 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.067 1.506 . . . . 10.0 115.067 -168.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -115.98 -44.56 2.91 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.582 1.553 . . . . 10.0 110.93 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.24 -8.07 5.18 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.81 1.041 . . . . 10.0 113.81 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.57 -15.51 58.27 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.477 1.511 . . . . 10.0 113.057 166.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -143.92 -44.87 0.27 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.934 1.694 . . . . 10.0 113.037 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -85.72 -164.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.768 2.027 . . . . 10.0 110.593 171.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.428 HG23 ' H ' ' A' ' 20' ' ' VAL . 1.4 t -150.19 -77.06 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.528 1.131 . . . . 10.0 111.153 168.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.428 ' H ' HG23 ' A' ' 19' ' ' THR 0.268 0.9 OUTLIER 49.75 -18.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 129.699 3.2 . . . . 10.0 117.204 -171.812 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 23' ' ' GLY . 14.8 pt-20 -68.42 51.21 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 129.336 3.054 . . . . 10.0 113.315 175.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 mttm 57.71 -21.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 129.466 3.106 . . . . 10.0 117.013 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.422 ' H ' ' C ' ' A' ' 21' ' ' GLU . . . . . . . . 0 CA--C 1.533 1.176 0 C-N-CA 126.501 2.0 . . . . 10.0 112.637 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.723 -0.656 . . . . 10.0 111.884 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.06 150.85 17.27 Favored Glycine 0 CA--C 1.546 2.02 0 C-N-CA 124.666 1.127 . . . . 10.0 111.689 161.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -78.4 38.98 0.73 Allowed 'Trans proline' 0 CA--C 1.542 0.911 1 C-N-CA 125.354 4.036 . . . . 10.0 116.634 -163.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 56.42 -163.37 0.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.646 -1.284 . . . . 10.0 110.22 -161.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.56 27.44 1.53 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.28 1.832 . . . . 10.0 111.577 172.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.14 107.26 0.22 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.635 2.374 . . . . 10.0 114.339 -176.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.03 11.34 58.35 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 126.084 1.802 . . . . 10.0 115.045 173.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 161.89 4.21 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.174 0.987 . . . . 10.0 110.403 166.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 62.77 44.43 6.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.564 1.546 . . . . 10.0 113.121 -155.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 164.08 -44.13 0.31 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.452 1.501 . . . . 10.0 111.034 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 -82.24 159.09 23.29 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.411 0.624 . . . . 10.0 111.495 169.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -85.36 164.92 17.66 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.96 1.304 . . . . 10.0 111.66 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.9 t -60.65 151.35 29.35 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.882 1.273 . . . . 10.0 111.787 171.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.36 8.44 49.85 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 117.154 1.622 . . . . 10.0 117.154 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.527 ' H ' ' NE2' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -65.87 -15.73 63.19 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 115.604 1.705 . . . . 10.0 115.604 -171.258 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.38 109.43 1.37 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.452 1.901 . . . . 10.0 114.868 -162.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.04 52.92 3.99 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.469 3.446 . . . . 10.0 112.395 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 126.94 73.84 0.19 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.498 1.523 . . . . 10.0 112.328 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -157.2 -79.94 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.918 0.887 . . . . 10.0 111.485 171.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 24.7 m 55.28 102.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.511 1.525 . . . . 10.0 112.176 -155.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -55.03 4.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.582 1.953 . . . . 10.0 110.305 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 71.9 p -144.69 175.81 9.89 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.216 2.606 . . . . 10.0 108.04 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -76.6 -60.48 2.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.804 1.642 . . . . 10.0 112.84 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.16 -52.45 65.29 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.766 1.226 . . . . 10.0 113.883 -153.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -58.82 -58.87 6.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.599 0.76 . . . . 10.0 112.885 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -39.95 76.34 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.528 1.131 . . . . 10.0 113.139 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -61.67 -34.91 76.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.178 0.899 . . . . 10.0 113.241 173.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -75.13 -10.99 59.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.118 1.525 . . . . 10.0 115.118 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.06 12.29 57.23 Favored Glycine 0 CA--C 1.542 1.781 0 N-CA-C 117.663 1.825 . . . . 10.0 117.663 163.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -55.4 4.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 119.449 3.129 . . . . 10.0 119.449 -161.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 m 55.62 104.58 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.825 2.45 . . . . 10.0 114.625 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.53 119.49 16.82 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 121.182 -0.949 . . . . 10.0 111.777 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.49 ' HZ2' ' CD ' ' A' ' 62' ' ' GLU . 21.3 tttm -163.81 167.84 20.34 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.593 1.157 . . . . 10.0 111.146 -155.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -68.61 23.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.81 2.844 . . . . 10.0 114.427 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.49 ' CD ' ' HZ2' ' A' ' 60' ' ' LYS . 3.5 mp0 -158.91 17.48 0.19 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.895 2.878 . . . . 10.0 110.651 -168.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.7 p -158.45 -37.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.244 1.818 . . . . 10.0 110.656 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -22.27 57.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 114.424 1.268 . . . . 10.0 114.424 174.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.7 mtm -67.76 -52.73 33.93 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.88 0.763 . . . . 10.0 110.686 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -61.97 -41.47 98.04 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.46 0.475 . . . . 10.0 110.527 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.76 -53.23 43.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 113.316 0.858 . . . . 10.0 113.316 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.7 tp -65.96 -33.47 75.9 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.062 1.301 . . . . 10.0 112.415 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -70.34 -28.3 65.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 172.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -161.38 75.94 2.42 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.626 1.17 . . . . 10.0 112.353 -172.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.99 -48.68 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.612 2.208 . . . . 10.0 111.93 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 32.38 0.08 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.35 2.26 . . . . 10.0 114.268 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.26 -43.65 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 128.006 2.522 . . . . 10.0 110.45 -167.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -68.06 -36.82 80.5 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 174.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.44 143.55 41.57 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.702 0.801 . . . . 10.0 111.224 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -76.72 158.75 35.4 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.151 2.568 . . . . 10.0 111.379 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 57.49 55.8 28.5 Favored Glycine 0 C--N 1.34 0.778 0 C-N-CA 123.868 0.747 . . . . 10.0 112.044 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -126.68 151.01 48.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.125 1.77 . . . . 10.0 109.445 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -142.55 5.92 1.63 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.332 1.453 . . . . 10.0 113.87 -169.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -54.75 92.64 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.746 1.618 . . . . 10.0 113.035 173.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.77 83.22 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.484 1.514 . . . . 10.0 110.069 175.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -162.3 -53.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.069 0.766 . . . . 10.0 113.069 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.71 87.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.078 2.551 . . . . 10.0 117.254 168.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.78 95.87 1.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 123.374 0.511 . . . . 10.0 112.134 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.65 -21.11 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -166.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 88' ' ' LYS . 0.6 OUTLIER 73.63 148.33 0.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.162 2.585 . . . . 10.0 110.943 -174.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm 46.95 -13.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 130.554 3.541 . . . . 10.0 118.298 -162.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 86' ' ' LYS . 43.6 mttm 49.11 -9.72 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 131.406 3.882 . . . . 10.0 118.754 163.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.0 m -63.9 -26.77 68.75 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 122.726 2.512 . . . . 10.0 111.188 156.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -53.29 -33.32 52.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.195 0.998 . . . . 10.0 112.955 163.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -66.59 -44.49 82.02 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 116.981 -1.485 . . . . 10.0 110.404 172.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.17 -45.42 93.15 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.419 1.009 . . . . 10.0 110.335 177.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -59.79 -49.42 77.8 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.467 1.507 . . . . 10.0 110.911 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -40.95 97.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.469 0.914 . . . . 10.0 113.469 174.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.8 mm -54.71 -56.2 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 171.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.54 42.76 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.028 0.931 . . . . 10.0 111.075 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.436 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 9.2 t80 -52.0 -59.11 4.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.081 1.752 . . . . 10.0 112.36 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.436 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 15.1 mt -71.51 -30.91 66.48 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.946 0.794 . . . . 10.0 113.01 -175.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -52.97 62.37 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 118.995 0.816 . . . . 10.0 109.862 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -37.72 82.51 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 117.453 -1.26 . . . . 10.0 113.189 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.73 -7.18 4.45 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.8 p -69.41 -16.92 63.6 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.883 -1.136 . . . . 10.0 113.538 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -153.61 43.73 0.59 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.77 1.228 . . . . 10.0 111.8 -162.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 129.635 3.174 . . . . 10.0 110.506 163.276 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.019 0 N-CA-C 109.693 -1.363 . . . . 10.0 109.693 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -109.33 150.56 27.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.147 0.979 . . . . 10.0 111.562 -174.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.6 m -70.8 -40.27 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 121.244 -0.91 . . . . 10.0 112.24 -174.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 mp0 -59.12 -51.84 68.3 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.425 1.49 . . . . 10.0 110.288 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -56.93 -21.61 31.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.995 1.718 . . . . 10.0 114.167 174.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.74 -43.04 3.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 119.074 0.852 . . . . 10.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -60.8 -42.04 96.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.797 1.298 . . . . 10.0 112.757 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -36.51 81.8 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.55 1.14 . . . . 10.0 112.627 -176.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -85.99 -34.53 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 124.059 0.944 . . . . 10.0 111.217 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -57.35 -50.88 71.54 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 118.929 0.786 . . . . 10.0 110.318 171.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.4 t -65.01 -8.1 5.05 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -97.67 -48.69 5.13 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.241 1.417 . . . . 10.0 112.56 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.75 -0.24 9.68 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.391 1.626 . . . . 10.0 115.391 -171.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.2 m -117.61 -43.47 2.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.862 1.265 . . . . 10.0 111.655 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.88 -10.09 8.47 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -16.62 52.6 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 10.0 112.854 167.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.1 m -143.24 -34.82 0.41 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.468 1.507 . . . . 10.0 114.002 -175.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -105.45 174.25 5.96 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.362 2.665 . . . . 10.0 111.837 -178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.0 m -160.92 90.29 0.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 119.735 -1.853 . . . . 10.0 112.732 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.8 p -95.76 -36.26 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 N-CA-C 114.103 1.149 . . . . 10.0 114.103 171.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.406 ' O ' ' HE3' ' A' ' 22' ' ' LYS . 3.8 tt0 -71.96 -0.73 12.22 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.838 -1.164 . . . . 10.0 114.061 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 21' ' ' GLU . 11.8 mmtp -151.54 -166.27 2.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.057 2.543 . . . . 10.0 107.115 -169.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.692 0 N-CA-C 118.058 1.983 . . . . 10.0 118.058 -167.188 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 119.22 -0.419 . . . . 10.0 111.903 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -116.97 171.67 13.9 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 110.499 -1.04 . . . . 10.0 110.499 154.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -61.65 178.98 0.56 Allowed 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.846 5.031 . . . . 10.0 114.167 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -83.53 -10.24 58.43 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.325 1.602 . . . . 10.0 115.325 -168.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.4 mp 45.5 69.42 0.45 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.618 1.167 . . . . 10.0 110.59 -158.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.402 ' CE1' HH21 ' A' ' 38' ' ' ARG . 0.5 OUTLIER -55.56 -179.24 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.64 1.176 . . . . 10.0 111.51 163.19 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -36.53 137.92 0.45 Allowed Glycine 0 CA--C 1.538 1.523 0 O-C-N 121.491 -0.756 . . . . 10.0 112.356 161.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -151.86 171.74 17.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 130.064 3.346 . . . . 10.0 109.097 -167.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 68.38 86.19 0.13 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.03 1.732 . . . . 10.0 112.784 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.4 60.71 1.43 Allowed Glycine 0 CA--C 1.527 0.809 0 CA-C-N 115.016 -0.993 . . . . 10.0 112.989 172.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.402 HH21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -152.21 -94.26 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.494 1.118 . . . . 10.0 110.328 172.815 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -154.5 -129.41 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.651 1.18 . . . . 10.0 110.608 165.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.9 t -158.63 167.69 28.89 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 128.33 2.652 . . . . 10.0 108.082 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.18 46.29 4.17 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 115.98 1.152 . . . . 10.0 115.98 174.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -128.94 1.0 5.32 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.651 1.723 . . . . 10.0 115.651 -173.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.85 116.91 27.39 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 120.855 1.661 . . . . 10.0 112.225 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.83 -39.25 0.69 Allowed 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.495 2.13 . . . . 10.0 114.197 -158.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -119.15 49.08 0.89 Allowed Glycine 0 C--N 1.34 0.788 0 C-N-CA 124.439 1.018 . . . . 10.0 112.322 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -141.72 -41.04 0.36 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 118.384 -0.817 . . . . 10.0 113.172 -172.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 t 43.91 87.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.493 1.917 . . . . 10.0 115.297 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -172.9 4.03 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 126.647 1.979 . . . . 10.0 113.283 -172.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.7 p -64.13 155.45 31.49 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.222 -0.924 . . . . 10.0 111.793 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.18 -50.39 16.39 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.847 2.059 . . . . 10.0 112.41 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.32 30.64 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 128.379 2.672 . . . . 10.0 116.464 -164.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -161.23 -70.16 0.06 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.039 3.336 . . . . 10.0 107.145 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -55.3 22.59 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.997 1.719 . . . . 10.0 112.555 178.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.9 -32.34 73.8 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.269 0.94 . . . . 10.0 112.021 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -60.66 -16.56 40.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.011 1.325 . . . . 10.0 113.337 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.68 14.93 79.51 Favored Glycine 0 CA--C 1.535 1.308 0 N-CA-C 115.914 1.126 . . . . 10.0 115.914 163.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -55.45 0.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.219 2.607 . . . . 10.0 117.993 -167.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.8 m 55.47 107.51 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 128.941 2.896 . . . . 10.0 115.161 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -67.82 131.63 45.88 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.747 0.784 . . . . 10.0 112.576 170.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -165.1 162.66 20.35 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.348 1.459 . . . . 10.0 110.682 -155.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.35 35.28 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 129.399 3.08 . . . . 10.0 113.602 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -162.06 -74.54 0.05 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 128.235 2.614 . . . . 10.0 107.578 -164.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.4 p -57.88 -37.03 73.24 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.064 2.145 . . . . 10.0 112.582 -176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -23.61 55.49 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.765 1.226 . . . . 10.0 113.68 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 35.7 mtm -71.99 -48.27 46.05 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.65 -0.656 . . . . 10.0 109.948 170.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -57.5 -51.79 68.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.657 1.183 . . . . 10.0 110.829 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -59.3 -52.03 67.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 118.308 -0.853 . . . . 10.0 112.44 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -48.04 79.59 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.591 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.6 -29.13 70.37 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.27 1.211 . . . . 10.0 114.27 -177.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -162.25 97.71 1.17 Allowed Pre-proline 0 CA--C 1.546 0.8 0 CA-C-N 119.156 0.889 . . . . 10.0 112.01 161.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.14 -49.22 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.398 2.065 . . . . 10.0 110.838 -172.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -61.4 -23.19 65.63 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.956 1.702 . . . . 10.0 113.775 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -52.56 9.54 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.028 1.331 . . . . 10.0 112.273 163.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -61.85 -32.38 72.71 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.122 0.786 . . . . 10.0 113.122 -175.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.54 148.0 54.42 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 126.077 1.751 . . . . 10.0 110.82 172.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.42 -8.45 19.59 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.94 2.427 . . . . 10.0 114.094 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -141.25 78.52 0.29 Allowed Glycine 0 C--N 1.34 0.763 0 C-N-CA 123.938 0.78 . . . . 10.0 113.126 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.7 m -133.91 119.46 19.14 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.746 0.818 . . . . 10.0 113.091 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -85.99 6.12 30.18 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 116.016 1.858 . . . . 10.0 116.016 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.57 109.32 0.68 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.438 1.095 . . . . 10.0 111.364 173.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 26.0 mm -83.74 77.31 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 124.999 1.319 . . . . 10.0 110.035 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -163.85 -42.74 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 167.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.67 -146.19 0.2 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.296 1.038 . . . . 10.0 113.198 -162.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.0 150.26 28.86 Favored Glycine 0 C--N 1.343 0.949 0 C-N-CA 124.607 1.099 . . . . 10.0 115.479 -163.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 tt -69.58 -9.86 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.552 1.316 . . . . 10.0 114.552 -163.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.2 tttm 56.68 51.11 11.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.686 1.994 . . . . 10.0 111.716 -178.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.31 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.046 1.738 . . . . 10.0 115.235 175.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 mptt 47.5 -56.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 129.441 3.096 . . . . 10.0 116.351 -162.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.5 m -58.66 -37.61 76.36 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 121.358 1.89 . . . . 10.0 112.495 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -52.75 -38.47 60.96 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.356 0.662 . . . . 10.0 111.86 171.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -46.69 89.48 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.839 -1.163 . . . . 10.0 110.932 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.95 -22.77 55.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.783 1.031 . . . . 10.0 113.783 175.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -62.85 -49.76 73.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.813 1.188 . . . . 10.0 110.264 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mp -59.51 -40.58 87.58 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.148 -0.97 . . . . 10.0 113.29 174.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.59 -48.79 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 119.053 0.842 . . . . 10.0 109.022 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -50.23 74.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.101 0.409 . . . . 10.0 111.344 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -53.71 -55.73 23.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.006 1.323 . . . . 10.0 112.847 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.97 -28.71 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.326 0.966 . . . . 10.0 112.608 -175.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -66.63 -18.96 65.65 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.376 1.071 . . . . 10.0 112.625 171.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -85.95 -58.19 2.74 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 117.223 -1.37 . . . . 10.0 111.377 158.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.16 -18.62 37.85 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 115.948 1.833 . . . . 10.0 115.948 -170.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.2 t -64.19 -19.97 65.7 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.011 1.324 . . . . 10.0 114.509 166.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.22 -4.21 0.2 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.538 2.051 . . . . 10.0 116.538 -167.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 C--O 1.25 1.095 0 C-N-CA 126.155 1.782 . . . . 10.0 111.274 -171.525 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 CA-C-O 118.111 -1.383 . . . . 10.0 114.828 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -80.7 163.98 23.15 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.606 1.703 . . . . 10.0 111.442 166.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.03 -50.3 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.678 1.191 . . . . 10.0 110.597 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.36 -49.95 65.16 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.951 -1.093 . . . . 10.0 113.114 -170.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -57.29 -32.1 66.3 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.732 0.413 . . . . 10.0 111.527 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.34 -41.74 58.32 Favored Glycine 0 C--N 1.34 0.754 0 C-N-CA 124.535 1.064 . . . . 10.0 111.287 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -69.7 -33.8 73.02 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 118.15 0.975 . . . . 10.0 111.978 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -53.58 55.9 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.932 1.293 . . . . 10.0 110.311 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.96 -33.19 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 118.61 -0.709 . . . . 10.0 112.696 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.419 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.7 t80 -56.59 -54.08 50.18 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 119.725 1.148 . . . . 10.0 110.723 170.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.87 -10.09 6.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 112.932 0.715 . . . . 10.0 112.932 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -90.06 -52.32 5.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.195 1.398 . . . . 10.0 111.354 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -134.55 10.12 3.7 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -167.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.0 m -113.26 -42.29 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.11 1.364 . . . . 10.0 110.719 167.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.35 -14.61 19.54 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -66.13 -10.28 39.41 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.923 1.689 . . . . 10.0 114.741 168.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -143.43 -34.68 0.4 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.76 1.224 . . . . 10.0 112.98 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -114.41 -175.42 2.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.597 2.359 . . . . 10.0 111.956 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -146.04 176.74 9.49 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.317 0.647 . . . . 10.0 110.756 151.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.3 p -162.34 -41.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 127.139 2.176 . . . . 10.0 109.765 156.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -67.47 -51.9 45.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.996 0.918 . . . . 10.0 111.091 166.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -85.26 82.87 8.19 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.5 1.12 . . . . 10.0 110.158 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.23 0 C-N-CA 127.341 2.401 . . . . 10.0 115.757 167.567 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 119.499 -0.286 . . . . 10.0 110.957 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -144.51 175.92 23.97 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.814 2.15 . . . . 10.0 110.82 160.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.07 -179.18 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.273 3.982 . . . . 10.0 113.936 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -93.68 16.27 14.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.347 2.659 . . . . 10.0 115.741 -169.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp 38.85 55.1 2.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.99 2.116 . . . . 10.0 112.924 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -56.94 84.73 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.595 2.758 . . . . 10.0 114.112 -178.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.25 32.19 60.07 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.413 1.482 . . . . 10.0 114.962 166.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.0 179.25 0.71 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.183 0.993 . . . . 10.0 113.429 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.447 ' CB ' ' HE2' ' A' ' 99' ' ' LYS . 4.1 m-85 52.81 42.95 31.98 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 124.802 1.241 . . . . 10.0 111.068 -166.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 1.68 0.07 OUTLIER Glycine 0 CA--C 1.542 1.77 0 C-N-CA 126.945 2.212 . . . . 10.0 115.208 -163.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.9 mtp85 -152.41 163.33 39.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.118 1.767 . . . . 10.0 110.848 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -83.72 172.76 11.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.02 2.128 . . . . 10.0 112.999 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 50.6 p -81.73 179.63 7.75 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.581 1.152 . . . . 10.0 112.125 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.72 -32.1 4.07 Favored Glycine 0 CA--C 1.529 0.956 0 O-C-N 120.88 -1.137 . . . . 10.0 114.5 176.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 44.3 mm-40 -64.98 6.32 0.25 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 128.708 2.803 . . . . 10.0 116.623 -161.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.17 145.0 79.76 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 119.405 1.002 . . . . 10.0 108.939 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.57 70.31 4.97 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.415 2.743 . . . . 10.0 111.323 -177.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.444 ' C ' ' H ' ' A' ' 47' ' ' THR . . . 68.35 -79.27 0.23 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.918 1.723 . . . . 10.0 111.987 -173.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 48.62 -14.33 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 130.438 3.495 . . . . 10.0 117.883 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 45' ' ' GLY . 26.2 m 76.38 75.82 0.09 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 129.787 3.235 . . . . 10.0 112.025 -171.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -84.27 170.0 14.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.943 1.297 . . . . 10.0 111.849 159.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 82.1 p -69.59 -1.37 8.64 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 116.226 1.936 . . . . 10.0 116.226 -172.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.4 t70 46.3 -157.33 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.456 0.702 . . . . 10.0 110.912 -146.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.25 -76.12 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.357 2.663 . . . . 10.0 113.147 -168.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -49.94 -71.64 0.06 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.212 1.805 . . . . 10.0 111.4 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -57.07 -42.3 80.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.616 1.966 . . . . 10.0 111.246 -172.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.11 -59.9 3.61 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.591 2.356 . . . . 10.0 112.525 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -62.29 -52.01 65.41 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.905 0.882 . . . . 10.0 111.552 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.3 -179.99 19.01 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 122.436 1.02 . . . . 10.0 115.203 -172.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.07 -1.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 128.747 2.819 . . . . 10.0 112.544 -169.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.8 m 55.39 106.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.86 2.064 . . . . 10.0 113.181 -162.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -67.38 123.15 19.57 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.31 -0.869 . . . . 10.0 111.692 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -162.57 178.15 8.81 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.172 2.189 . . . . 10.0 110.907 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.91 41.93 0.05 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.127 2.971 . . . . 10.0 113.344 -174.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -161.64 -64.45 0.05 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.563 3.145 . . . . 10.0 108.396 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.1 p -62.48 -43.81 97.92 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.176 1.39 . . . . 10.0 112.416 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.69 -25.3 60.17 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.131 0.573 . . . . 10.0 111.405 173.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 34.3 ttm -63.95 -52.42 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.204 0.911 . . . . 10.0 109.234 170.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -60.86 -44.67 96.7 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.499 0.72 . . . . 10.0 111.146 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.29 -48.27 76.31 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.499 -0.762 . . . . 10.0 111.674 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -42.16 99.01 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.079 1.308 . . . . 10.0 111.066 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.97 -45.51 74.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.107 0.867 . . . . 10.0 112.282 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -160.6 76.77 2.62 Favored Pre-proline 0 CA--C 1.559 1.307 0 C-N-CA 124.656 1.182 . . . . 10.0 111.034 -163.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.92 -67.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.473 3.449 . . . . 10.0 114.271 -161.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -58.64 -20.29 46.56 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.176 1.79 . . . . 10.0 113.233 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -48.06 24.58 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.828 2.051 . . . . 10.0 111.428 170.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -61.19 -41.1 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.629 0.772 . . . . 10.0 112.855 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 pt -139.53 135.89 17.29 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.711 0.805 . . . . 10.0 111.208 -175.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -78.37 65.92 8.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.438 3.425 . . . . 10.0 112.786 -168.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.36 -145.96 4.65 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 126.423 1.963 . . . . 10.0 109.614 175.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 93.0 m 74.86 147.6 0.09 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.065 2.146 . . . . 10.0 114.636 168.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -141.56 21.6 2.18 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.946 2.098 . . . . 10.0 111.666 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 21.7 ttt -59.49 98.6 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.156 1.382 . . . . 10.0 109.561 158.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.5 mp -75.57 57.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.262 1.025 . . . . 10.0 110.3 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -163.64 107.05 0.99 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.29 1.036 . . . . 10.0 111.417 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.89 -162.04 0.2 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.096 1.358 . . . . 10.0 111.942 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.26 60.26 0.01 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 127.58 2.514 . . . . 10.0 117.051 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.331 5.6 tt 44.71 -122.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.343 2.657 . . . . 10.0 112.042 175.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -142.31 -73.8 0.3 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.31 1.444 . . . . 10.0 110.15 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.81 115.52 3.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 161.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -64.04 -21.71 66.62 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.133 0.879 . . . . 10.0 111.373 170.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.7 m -53.1 -50.91 63.46 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.145 0.978 . . . . 10.0 112.339 164.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.25 -30.36 66.49 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.551 1.069 . . . . 10.0 111.341 176.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -19.57 59.48 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.545 1.138 . . . . 10.0 113.869 173.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.76 -62.97 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.398 1.454 . . . . 10.0 108.189 160.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.58 -48.48 72.05 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 126.458 1.903 . . . . 10.0 111.198 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.2 tp -60.44 -47.7 84.96 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.7 mm -65.57 -44.02 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.905 -0.497 . . . . 10.0 110.075 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.53 -35.39 80.33 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.217 1.007 . . . . 10.0 111.609 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.431 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.0 t80 -57.12 -66.44 0.45 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.675 1.19 . . . . 10.0 110.952 165.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.431 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 51.7 mt -62.86 -29.9 71.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.447 ' HE2' ' CB ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -57.46 -46.92 83.11 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.54 1.064 . . . . 10.0 110.983 172.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -91.22 -38.24 12.82 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 117.983 -1.008 . . . . 10.0 111.684 -172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.71 -13.33 9.53 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.837 1.655 . . . . 10.0 115.013 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.58 -2.38 14.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.581 1.152 . . . . 10.0 113.346 168.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -151.4 -53.8 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.73 2.012 . . . . 10.0 111.816 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 126.697 1.999 . . . . 10.0 113.215 -178.176 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.768 0 CA-C-O 118.716 -1.047 . . . . 10.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -136.82 155.2 50.11 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.475 0.917 . . . . 10.0 113.475 -144.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 94.6 t -58.57 -56.09 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 126.183 1.793 . . . . 10.0 111.544 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -59.46 -36.46 75.99 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.37 1.468 . . . . 10.0 112.004 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -77.75 -8.97 58.73 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.221 1.808 . . . . 10.0 114.666 174.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.23 -41.47 5.51 Favored Glycine 0 N--CA 1.471 1.0 0 CA-C-N 119.707 1.14 . . . . 10.0 112.092 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.08 68.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.726 -0.867 . . . . 10.0 113.036 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -30.07 67.71 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.492 1.293 . . . . 10.0 114.492 177.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -86.11 -31.1 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 119.026 0.83 . . . . 10.0 110.325 173.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.457 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t80 -58.08 -52.02 67.26 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 122.072 -0.393 . . . . 10.0 111.336 169.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.86 -9.89 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.366 0.876 . . . . 10.0 113.366 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -82.55 -52.18 7.08 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.055 0.942 . . . . 10.0 110.742 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -116.06 -52.67 2.59 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.285 1.034 . . . . 10.0 112.595 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.457 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 9.5 m -59.53 -43.01 93.59 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.902 0.881 . . . . 10.0 112.666 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.2 23.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.658 1.355 . . . . 10.0 114.658 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.88 -14.77 63.11 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.618 1.099 . . . . 10.0 112.252 170.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 91.7 m -143.03 -26.95 0.58 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.665 1.358 . . . . 10.0 114.665 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.408 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.4 m-70 -109.54 -56.26 2.33 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.201 1.4 . . . . 10.0 114.127 -174.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.294 9.8 t 44.67 53.31 7.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.187 1.795 . . . . 10.0 114.016 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.71 -28.38 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 120.789 -1.194 . . . . 10.0 112.752 175.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.82 4.74 0.26 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.542 1.937 . . . . 10.0 114.712 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -149.79 13.57 0.81 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.75 2.42 . . . . 10.0 111.501 169.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.173 0 C-N-CA 124.86 1.219 . . . . 10.0 112.957 -173.17 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 113.332 0.864 . . . . 10.0 113.332 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.99 165.82 21.65 Favored Glycine 0 CA--C 1.54 1.656 0 CA-C-N 119.645 1.111 . . . . 10.0 110.99 157.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.408 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 49.3 Cg_endo -67.96 22.86 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.045 1 C-N-CA 126.478 4.785 . . . . 10.0 116.342 -173.728 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.349 0.0 OUTLIER 49.56 6.38 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 128.726 2.811 . . . . 10.0 117.931 -169.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.11 -34.21 0.28 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.728 2.411 . . . . 10.0 113.966 171.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.43 68.11 0.17 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 131.148 3.779 . . . . 10.0 114.13 169.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 32.85 68.05 0.18 Allowed Glycine 0 C--N 1.345 1.061 0 C-N-CA 127.587 2.517 . . . . 10.0 113.456 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -93.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.661 0.785 . . . . 10.0 112.322 -164.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 33.86 62.05 0.46 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.749 2.42 . . . . 10.0 115.358 161.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.35 -24.32 16.11 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.095 1.807 . . . . 10.0 114.151 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -68.06 168.18 12.5 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.955 1.378 . . . . 10.0 111.059 164.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -84.96 166.04 17.09 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.082 1.141 . . . . 10.0 114.082 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.4 p -67.55 -71.57 0.2 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 128.42 2.688 . . . . 10.0 112.964 -174.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -73.5 67.7 1.55 Allowed Glycine 0 C--N 1.339 0.703 0 C-N-CA 126.99 2.233 . . . . 10.0 112.988 -171.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.86 -2.98 7.73 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -173.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.06 118.84 59.47 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.551 1.14 . . . . 10.0 111.592 -176.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.89 81.75 1.86 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.069 2.513 . . . . 10.0 113.088 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.96 -7.75 70.09 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 125.403 1.478 . . . . 10.0 115.249 170.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -64.37 113.72 3.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.047 1.339 . . . . 10.0 110.615 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 m -71.18 142.55 50.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.399 1.48 . . . . 10.0 111.657 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.616 ' CG ' ' HE3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -155.0 178.41 10.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.082 1.142 . . . . 10.0 114.082 -169.221 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 p -67.52 120.93 14.77 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 10.0 111.924 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -75.07 36.38 0.11 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.676 1.59 . . . . 10.0 113.601 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.97 11.45 2.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.128 1.371 . . . . 10.0 114.625 -166.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.66 -33.97 0.05 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 117.905 -1.045 . . . . 10.0 113.791 -168.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.616 ' HE3' ' CG ' ' A' ' 48' ' ' TYR . 1.7 mppt? -64.48 -48.81 73.83 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.763 1.165 . . . . 10.0 108.071 166.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -49.01 -34.89 14.07 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.133 3.773 . . . . 10.0 113.82 176.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -68.71 -16.36 63.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.832 1.049 . . . . 10.0 113.832 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 58' ' ' THR . . . 70.94 5.13 57.3 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.296 1.279 . . . . 10.0 116.296 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.9 pp -61.24 14.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 128.995 2.918 . . . . 10.0 116.706 -173.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.401 ' H ' ' C ' ' A' ' 56' ' ' GLY . 99.9 m 40.6 81.14 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.568 2.747 . . . . 10.0 112.504 155.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -54.6 137.08 44.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.167 1.387 . . . . 10.0 111.692 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.258 0.0 OUTLIER -161.46 -73.72 0.06 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.734 1.383 . . . . 10.0 114.734 -164.006 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -164.68 20.32 0.06 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 121.145 1.793 . . . . 10.0 113.092 -171.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -160.72 -63.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.963 1.305 . . . . 10.0 107.898 -162.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 46.3 p -60.81 -46.82 89.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 126.979 2.112 . . . . 10.0 110.651 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -28.86 66.47 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.932 1.293 . . . . 10.0 112.324 174.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.7 ttm -65.13 -51.13 63.1 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.053 0.541 . . . . 10.0 109.854 173.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -61.56 -46.18 90.99 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.269 1.028 . . . . 10.0 110.352 176.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.29 -53.01 50.31 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 118.585 -0.721 . . . . 10.0 112.799 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -26.44 66.71 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.257 1.389 . . . . 10.0 111.798 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.53 -25.2 45.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.976 1.473 . . . . 10.0 114.976 169.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.46 72.25 1.87 Allowed Pre-proline 0 CA--C 1.563 1.451 0 CA-C-N 119.746 1.157 . . . . 10.0 113.442 -174.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -71.5 -57.54 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.454 2.103 . . . . 10.0 113.283 -161.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.8 mttm -62.6 -27.88 69.5 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 127.081 2.153 . . . . 10.0 112.456 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.28 -46.62 32.38 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 126.284 1.834 . . . . 10.0 110.764 172.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -61.03 -49.29 78.01 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.271 0.841 . . . . 10.0 113.271 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 pt -135.97 131.29 18.86 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.661 0.784 . . . . 10.0 111.155 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -80.75 64.71 8.92 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.228 3.285 . . . . 10.0 113.33 -159.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 149.85 88.67 0.07 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 123.769 0.699 . . . . 10.0 111.59 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 19.0 m -143.89 100.26 3.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.616 1.166 . . . . 10.0 109.407 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -81.35 7.99 10.26 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.383 1.873 . . . . 10.0 115.0 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.3 ttt -50.14 107.55 0.17 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.106 0.866 . . . . 10.0 110.379 156.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.419 HD13 ' H ' ' A' ' 81' ' ' ILE . 3.0 mp -78.49 59.2 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.936 1.295 . . . . 10.0 110.521 -175.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -162.93 92.44 0.77 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.307 1.043 . . . . 10.0 110.358 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.36 -14.62 60.48 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.453 1.649 . . . . 10.0 115.453 -172.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -179.95 159.09 23.22 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.753 1.168 . . . . 10.0 111.19 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.434 HG21 ' H ' ' A' ' 86' ' ' LYS 0.315 20.5 tt -96.06 -96.29 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 -168.255 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 86' ' ' LYS . 9.3 mmpt? -146.83 103.4 3.63 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.017 1.327 . . . . 10.0 110.995 -171.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 47.22 -73.7 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 129.352 3.061 . . . . 10.0 114.421 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -164.18 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.825 1.65 . . . . 10.0 112.931 157.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 m -52.71 -52.29 56.74 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.771 1.228 . . . . 10.0 112.592 -171.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -58.89 -26.37 64.22 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.984 0.811 . . . . 10.0 112.622 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -23.66 58.18 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.559 0.743 . . . . 10.0 112.251 176.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -70.28 -53.89 14.96 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.085 -1.009 . . . . 10.0 110.101 168.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.08 -47.32 78.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 10.0 110.544 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 45.5 tp -56.93 -48.29 78.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.735 1.614 . . . . 10.0 113.821 172.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 15.4 mm -61.69 -44.36 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 118.858 0.754 . . . . 10.0 109.911 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.22 84.05 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.548 0.739 . . . . 10.0 111.82 175.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -55.62 -60.51 3.33 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.52 0.728 . . . . 10.0 111.756 171.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.77 -21.65 62.48 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.794 1.179 . . . . 10.0 113.99 -172.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.76 -59.77 4.26 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.485 0.714 . . . . 10.0 109.989 159.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 mmtt -61.89 -28.23 69.36 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.36 -1.305 . . . . 10.0 113.387 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.72 -13.92 7.24 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.801 1.637 . . . . 10.0 114.698 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.8 p -74.61 -20.58 59.86 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.882 1.438 . . . . 10.0 114.882 166.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -155.8 15.87 0.36 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 115.175 1.546 . . . . 10.0 115.175 -164.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 115.314 -2.279 . . . . 10.0 113.819 173.636 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 111.013 -0.835 . . . . 10.0 111.013 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.06 151.51 28.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.32 2.248 . . . . 10.0 114.404 -163.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -58.13 -35.62 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 120.763 -1.21 . . . . 10.0 113.228 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 -63.81 -48.89 75.06 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.564 1.546 . . . . 10.0 111.216 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -57.57 -34.11 68.85 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.589 0.755 . . . . 10.0 111.574 172.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.79 -51.61 39.54 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.15 -1.18 . . . . 10.0 110.15 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.259 1.1 ptpm? -64.16 -38.25 90.39 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 118.401 1.101 . . . . 10.0 113.657 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.26 -37.7 78.06 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.595 1.089 . . . . 10.0 113.357 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mm -69.4 -39.99 79.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 120.025 1.284 . . . . 10.0 110.96 172.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -56.38 -49.01 75.69 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.544 -0.723 . . . . 10.0 110.35 174.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.15 -11.59 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.976 1.102 . . . . 10.0 113.976 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -84.95 -33.75 22.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.329 1.051 . . . . 10.0 112.275 -177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -132.02 -63.52 0.81 Allowed 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 126.159 1.784 . . . . 10.0 111.148 -172.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 m -53.64 -47.73 70.05 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.551 1.14 . . . . 10.0 112.784 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.24 -17.57 62.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.046 1.128 . . . . 10.0 114.046 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.01 -7.82 32.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.268 1.427 . . . . 10.0 112.781 174.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -141.67 -21.28 0.74 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.613 1.565 . . . . 10.0 113.186 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -126.23 -5.74 6.62 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -170.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.2 m 54.94 -79.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.934 2.093 . . . . 10.0 116.193 -177.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.8 t 46.95 -59.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.276 1 C-N-CA 131.711 4.004 . . . . 10.0 116.041 -167.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -71.72 14.05 0.23 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.511 1.924 . . . . 10.0 113.687 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -153.78 -166.53 2.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.474 2.71 . . . . 10.0 108.522 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.716 0 C-N-CA 125.552 1.548 . . . . 10.0 116.332 179.781 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 111.886 0.328 . . . . 10.0 111.886 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -138.8 173.66 22.48 Favored Glycine 0 CA--C 1.544 1.871 0 C-N-CA 126.51 2.005 . . . . 10.0 110.716 162.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 66.9 Cg_endo -71.64 -144.86 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.08 1 C-N-CA 125.379 4.052 . . . . 10.0 109.741 168.193 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -142.81 150.98 40.66 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 119.87 -1.769 . . . . 10.0 110.452 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.62 70.61 7.39 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 81.98 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 10.0 110.234 172.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.1 -67.78 0.48 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.584 2.516 . . . . 10.0 113.303 -176.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.11 -161.68 0.16 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.817 1.647 . . . . 10.0 111.064 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 60.43 64.37 1.22 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.204 1.801 . . . . 10.0 111.422 -173.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.7 42.58 0.86 Allowed Glycine 0 CA--C 1.532 1.151 0 CA-C-N 113.451 -1.704 . . . . 10.0 113.54 -172.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -150.95 150.5 30.89 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.21 1.404 . . . . 10.0 110.668 -177.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 163.59 18.41 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.909 1.077 . . . . 10.0 113.909 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.5 -16.62 58.61 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.278 1.831 . . . . 10.0 113.822 174.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.36 58.41 1.56 Allowed Glycine 0 CA--C 1.536 1.361 0 O-C-N 120.224 -1.547 . . . . 10.0 112.51 170.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -150.31 110.34 4.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.701 2.0 . . . . 10.0 112.238 -170.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.84 157.3 14.01 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.791 1.636 . . . . 10.0 110.376 165.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -84.81 -126.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 124.684 3.589 . . . . 10.0 109.215 159.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.92 79.78 0.37 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.368 1.461 . . . . 10.0 113.48 177.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 78.6 t80 -144.73 176.4 9.47 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.352 1.861 . . . . 10.0 110.714 172.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 96.7 m -154.39 100.03 2.25 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.881 -1.762 . . . . 10.0 110.832 171.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.61 167.64 16.07 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.338 2.255 . . . . 10.0 112.008 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.8 p -70.7 130.62 42.23 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.125 0.964 . . . . 10.0 111.051 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -33.2 71.86 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.364 1.616 . . . . 10.0 115.364 -162.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.25 -14.57 60.94 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.207 1.188 . . . . 10.0 114.207 -177.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -64.62 -70.06 0.25 Allowed 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.77 1.168 . . . . 10.0 110.244 169.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.16 -41.9 28.13 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.447 1.099 . . . . 10.0 112.104 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.17 -23.66 67.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.835 1.254 . . . . 10.0 114.002 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -74.01 -24.33 59.55 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.26 0.936 . . . . 10.0 112.677 170.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 65.32 12.62 56.22 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 116.844 1.498 . . . . 10.0 116.844 160.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.17 -12.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 129.221 3.008 . . . . 10.0 118.38 -160.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.0 m 56.73 118.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 128.197 2.599 . . . . 10.0 114.006 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 29.0 m95 -75.4 122.17 23.38 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.107 -0.951 . . . . 10.0 112.543 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -163.94 -177.94 5.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 130.207 3.403 . . . . 10.0 107.663 169.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.4 ' C ' ' H ' ' A' ' 63' ' ' THR . 2.7 pm0 -46.71 -57.94 4.35 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.956 1.253 . . . . 10.0 112.654 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -57.93 15.89 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 130.093 3.357 . . . . 10.0 116.691 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.4 ' H ' ' C ' ' A' ' 61' ' ' GLU . 57.8 p -158.15 -43.07 0.06 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.221 1.809 . . . . 10.0 109.976 -175.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.82 -33.54 60.08 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.735 1.214 . . . . 10.0 113.102 174.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.6 tpp -65.93 -48.96 69.66 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.803 0.729 . . . . 10.0 109.472 174.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.74 -43.87 97.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.634 1.173 . . . . 10.0 109.953 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -58.02 -64.61 0.85 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.224 -0.893 . . . . 10.0 111.719 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -24.4 67.58 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.494 1.497 . . . . 10.0 113.686 -174.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -73.48 -22.87 60.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.745 1.387 . . . . 10.0 114.745 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.98 71.13 2.35 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 120.194 1.361 . . . . 10.0 111.487 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.68 -48.03 0.82 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.225 1.95 . . . . 10.0 111.506 -164.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.7 mtmt -70.28 33.43 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 128.313 2.645 . . . . 10.0 114.097 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -161.91 -39.14 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 127.114 2.165 . . . . 10.0 112.0 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -65.39 -34.21 77.78 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.169 0.44 . . . . 10.0 111.721 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.98 153.25 78.43 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.396 1.078 . . . . 10.0 111.022 171.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.38 93.81 0.75 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.058 3.172 . . . . 10.0 112.757 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.69 49.17 6.25 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.962 0.745 . . . . 10.0 114.962 161.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.1 m -65.39 -19.7 66.06 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.579 1.326 . . . . 10.0 114.579 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 64.87 -45.93 0.34 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.417 2.287 . . . . 10.0 115.653 -176.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.2 ttt 2.7 97.51 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 129.547 3.139 . . . . 10.0 115.393 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . 0.267 9.9 tp -76.12 74.72 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 122.547 1.165 . . . . 10.0 112.237 -178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -162.45 -66.6 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.35 1.86 . . . . 10.0 109.981 170.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.11 -0.56 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 119.927 3.306 . . . . 10.0 119.927 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.17 95.5 0.22 Allowed Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.765 1.621 . . . . 10.0 113.209 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 tp -67.27 159.46 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.904 0.882 . . . . 10.0 112.19 174.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -64.71 -42.03 95.58 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.946 1.298 . . . . 10.0 114.384 -174.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.6 ptpp? -162.97 170.21 18.42 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.585 1.954 . . . . 10.0 109.555 165.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -55.91 -32.1 63.46 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.4 m -56.87 -37.27 71.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.757 1.223 . . . . 10.0 113.235 173.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -77.19 -15.53 59.46 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.698 1.199 . . . . 10.0 114.147 171.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.406 HH21 HG12 ' A' ' 95' ' ' ILE . 0.0 OUTLIER -76.54 -48.76 18.33 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.237 -1.539 . . . . 10.0 110.866 166.429 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -54.53 -55.47 28.86 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.94 1.296 . . . . 10.0 111.775 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -63.69 -35.48 80.7 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.149 0.796 . . . . 10.0 113.149 -172.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.1 mp -62.08 -42.61 99.38 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.834 1.254 . . . . 10.0 112.687 170.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.406 HG12 HH21 ' A' ' 91' ' ' ARG . 21.8 mm -59.57 -50.89 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.592 0.633 . . . . 10.0 109.754 171.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.62 83.57 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.752 0.821 . . . . 10.0 112.045 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -56.6 -57.49 12.13 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.904 1.282 . . . . 10.0 111.635 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.95 -25.88 62.92 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.927 1.239 . . . . 10.0 112.741 -173.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? -61.07 -29.17 69.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.242 1.017 . . . . 10.0 112.637 165.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -76.54 -51.65 11.29 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 125.145 1.378 . . . . 10.0 110.989 163.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.65 -22.51 13.85 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 121.474 1.943 . . . . 10.0 116.11 -174.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.8 0.73 12.24 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 169.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -153.92 -16.82 0.14 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 128.046 2.538 . . . . 10.0 115.499 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.255 1.356 0 C-N-CA 127.703 2.401 . . . . 10.0 111.792 -163.829 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.194 0 CA-C-O 118.217 -1.324 . . . . 10.0 113.642 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -134.55 118.0 16.79 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.627 . . . . 10.0 111.036 -139.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.7 p -50.27 -38.45 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.515 1.126 . . . . 10.0 112.658 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -59.78 -38.73 82.67 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.343 1.457 . . . . 10.0 113.724 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -73.98 -30.45 62.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.448 0.699 . . . . 10.0 110.766 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 8' ' ' LYS . . . -73.47 -50.71 11.13 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 -172.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 26.98 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.701 2.4 . . . . 10.0 115.146 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.401 ' H ' ' C ' ' A' ' 6' ' ' GLY . 0.0 OUTLIER -161.01 -28.5 0.06 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.385 1.474 . . . . 10.0 112.693 175.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.4 tp -70.19 -37.24 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 120.775 1.625 . . . . 10.0 110.925 161.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -55.54 -51.0 68.53 Favored 'General case' 0 C--N 1.347 0.486 0 O-C-N 121.258 -0.901 . . . . 10.0 110.395 168.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 t -66.89 -8.33 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -96.19 -48.83 5.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.227 1.411 . . . . 10.0 112.169 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -125.07 6.26 7.91 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.668 1.729 . . . . 10.0 115.668 -166.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.4 m -122.61 -44.05 2.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.51 1.924 . . . . 10.0 111.011 172.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.68 -21.59 60.77 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -55.1 -11.61 0.73 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.894 2.078 . . . . 10.0 115.334 169.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.8 m -141.84 -30.22 0.59 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.079 1.752 . . . . 10.0 111.566 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.417 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.3 m-70 -105.89 -20.43 13.44 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.656 1.354 . . . . 10.0 114.656 -176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.1 p 56.13 12.96 1.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 118.364 2.727 . . . . 10.0 118.364 173.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.0 t -66.29 165.45 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.273 1.829 . . . . 10.0 112.91 -173.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 87.95 0.15 0.44 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 130.14 3.376 . . . . 10.0 112.905 177.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -151.42 -172.1 4.12 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 128.493 2.717 . . . . 10.0 108.059 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.26 0 C-N-CA 125.221 1.391 . . . . 10.0 112.662 174.234 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 118.979 -0.534 . . . . 10.0 110.578 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.78 163.6 12.17 Favored Glycine 0 CA--C 1.544 1.871 0 N-CA-C 110.951 -0.86 . . . . 10.0 110.951 152.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.417 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 40.1 Cg_endo -75.8 0.43 9.23 Favored 'Trans proline' 0 CA--C 1.538 0.683 1 C-N-CA 125.784 4.323 . . . . 10.0 116.571 -175.258 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 64.92 145.34 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.987 2.515 . . . . 10.0 114.056 -163.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -85.26 73.29 10.61 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.225 -0.922 . . . . 10.0 109.493 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -161.93 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.469 0.707 . . . . 10.0 112.271 162.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.21 53.44 0.08 OUTLIER Glycine 0 CA--C 1.54 1.656 0 C-N-CA 127.473 2.463 . . . . 10.0 117.894 -164.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -70.8 177.9 3.37 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.033 2.533 . . . . 10.0 111.094 171.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.288 61.9 m-85 63.02 39.35 10.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.578 1.951 . . . . 10.0 112.24 -161.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.37 45.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.302 0 N-CA-C 116.3 1.28 . . . . 10.0 116.3 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.487 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -152.82 -99.45 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.498 1.649 . . . . 10.0 112.917 174.589 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.487 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -178.35 -165.94 0.1 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 131.563 3.945 . . . . 10.0 107.779 174.346 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.3 t -76.56 -140.7 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.446 1.098 . . . . 10.0 110.228 158.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.4 -69.48 3.36 Favored Glycine 0 CA--C 1.528 0.897 0 O-C-N 120.216 -1.553 . . . . 10.0 112.946 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -64.51 133.58 52.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.617 0.767 . . . . 10.0 111.648 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.85 110.75 0.84 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.93 2.092 . . . . 10.0 108.712 163.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.28 77.59 2.03 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.241 2.627 . . . . 10.0 114.498 -162.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.75 52.46 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.234 1.397 . . . . 10.0 114.587 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -64.16 -59.73 4.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.493 1.917 . . . . 10.0 114.347 -171.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m 77.52 127.07 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.165 2.586 . . . . 10.0 112.691 -164.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.17 -179.41 8.12 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.109 2.564 . . . . 10.0 111.061 -167.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -70.17 158.87 35.0 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.469 -0.769 . . . . 10.0 111.264 168.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.76 -41.98 35.7 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.888 1.811 . . . . 10.0 115.888 -176.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.02 -24.58 47.8 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.926 1.824 . . . . 10.0 115.926 -156.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -60.62 -53.4 57.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.849 0.86 . . . . 10.0 111.614 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.27 20.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.229 1.412 . . . . 10.0 111.926 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -58.1 -29.27 65.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.317 1.447 . . . . 10.0 113.727 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -72.91 -20.82 61.01 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.483 1.038 . . . . 10.0 113.759 178.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 59.06 11.08 10.51 Favored Glycine 0 CA--C 1.545 1.937 0 N-CA-C 119.217 2.447 . . . . 10.0 119.217 148.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.9 pt -50.33 -101.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 129.402 3.081 . . . . 10.0 115.796 -170.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -155.1 -27.42 0.11 Allowed 'General case' 0 N--CA 1.48 1.073 0 O-C-N 119.928 -1.733 . . . . 10.0 115.105 -173.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER 40.15 95.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.294 2.238 . . . . 10.0 113.757 -159.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -163.17 -175.04 4.1 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.267 2.627 . . . . 10.0 109.066 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -44.18 -53.89 6.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.224 2.21 . . . . 10.0 113.124 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.97 19.67 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.303 2.241 . . . . 10.0 116.199 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.3 p -160.05 -45.73 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.364 1.465 . . . . 10.0 110.716 -165.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.74 -22.24 56.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.634 1.174 . . . . 10.0 111.835 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -60.42 3.62 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.571 -0.9 . . . . 10.0 108.571 165.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.2 -37.68 83.86 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 110.538 -0.171 . . . . 10.0 110.538 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -70.43 -51.71 27.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 118.018 -0.991 . . . . 10.0 113.258 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.43 -34.05 76.43 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.356 1.889 . . . . 10.0 113.236 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -72.86 -29.58 63.3 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.101 0.778 . . . . 10.0 113.101 174.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.28 72.43 2.25 Favored Pre-proline 0 CA--C 1.561 1.374 0 N-CA-C 113.695 0.998 . . . . 10.0 113.695 -173.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.39 -50.31 0.73 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.736 2.958 . . . . 10.0 112.887 -165.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.74 -36.11 71.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.64 1.976 . . . . 10.0 112.921 177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -30.29 58.1 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.587 1.555 . . . . 10.0 112.793 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -75.78 -52.92 9.36 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.865 1.061 . . . . 10.0 113.865 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.0 pt -128.93 139.77 36.66 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 118.558 0.617 . . . . 10.0 112.279 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.55 146.89 56.54 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.939 2.426 . . . . 10.0 111.874 -168.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.13 10.84 10.32 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.82 1.2 . . . . 10.0 115.717 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.46 139.22 49.54 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.956 1.878 . . . . 10.0 110.4 175.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -84.8 -61.1 1.86 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 117.214 -1.374 . . . . 10.0 112.675 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.1 ttt 8.84 83.29 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 128.719 2.807 . . . . 10.0 114.098 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.24 74.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.307 1.443 . . . . 10.0 109.911 -171.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -163.15 -52.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.097 0.959 . . . . 10.0 112.911 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 40.15 82.82 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.261 2.225 . . . . 10.0 116.163 172.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.02 105.27 2.86 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.171 0.891 . . . . 10.0 111.781 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.2 tt -62.55 -50.86 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.864 -0.786 . . . . 10.0 112.494 -172.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.0 mttt 161.45 174.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 1 C-N-CA 132.291 4.236 . . . . 10.0 109.299 161.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 10.5 mmpt? 43.64 -98.59 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.962 2.505 . . . . 10.0 112.195 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.85 -49.0 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 129.681 3.192 . . . . 10.0 109.519 173.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 m -49.82 -46.66 51.36 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.736 2.014 . . . . 10.0 112.669 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -56.94 -35.97 69.71 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.108 0.963 . . . . 10.0 112.159 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -41.0 63.4 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.512 0.597 . . . . 10.0 111.032 175.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.04 -47.1 78.5 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 118.724 0.693 . . . . 10.0 111.997 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -57.14 -45.86 83.18 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.534 1.534 . . . . 10.0 111.818 174.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.02 -47.15 78.36 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 124.455 1.102 . . . . 10.0 113.364 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.5 mm -62.61 -46.06 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 118.355 -0.831 . . . . 10.0 109.145 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.05 82.52 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.966 0.803 . . . . 10.0 112.576 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.02 -63.19 1.17 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.281 1.032 . . . . 10.0 112.572 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.06 -37.63 80.42 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.787 0.835 . . . . 10.0 112.644 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -59.28 -16.94 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.126 0.97 . . . . 10.0 113.392 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -102.61 -45.04 5.16 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 117.529 -1.224 . . . . 10.0 113.725 160.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.58 62.77 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.57 1.692 . . . . 10.0 115.57 -173.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.8 p -72.37 -10.39 59.72 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.869 -1.144 . . . . 10.0 113.931 171.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -154.05 24.77 0.49 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.997 1.719 . . . . 10.0 111.938 -163.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . 0.253 5.4 pt-20 . . . . . 0 C--O 1.248 1.024 0 C-N-CA 126.387 1.875 . . . . 10.0 115.233 -159.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 110.433 -1.067 . . . . 10.0 110.433 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -150.31 169.72 20.71 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.351 1.46 . . . . 10.0 110.248 -177.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.7 t -58.11 -57.11 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.845 1.258 . . . . 10.0 109.803 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.456 ' OE2' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -62.85 -39.1 93.35 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.117 1.367 . . . . 10.0 113.995 179.255 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.65 -29.79 70.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.236 -0.888 . . . . 10.0 112.345 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -89.83 -43.21 5.17 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 124.92 1.248 . . . . 10.0 112.503 -170.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.456 ' HE2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.544 -0.974 . . . . 10.0 112.606 175.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -35.81 79.59 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.09 -0.957 . . . . 10.0 112.967 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.7 tp -78.2 -33.22 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.728 1.149 . . . . 10.0 110.889 176.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -57.07 -52.9 63.42 Favored 'General case' 0 C--N 1.342 0.263 0 O-C-N 121.224 -0.923 . . . . 10.0 110.437 166.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.4 t -65.8 -9.02 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 O-C-N 121.336 -0.853 . . . . 10.0 113.166 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.96 -37.79 10.05 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.662 1.585 . . . . 10.0 112.047 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptm -124.03 -14.08 7.17 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.817 1.414 . . . . 10.0 114.817 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.5 m -119.86 -39.89 2.8 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.772 1.629 . . . . 10.0 111.725 -172.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.96 -20.23 22.52 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 168.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.67 -21.05 2.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.692 1.997 . . . . 10.0 113.602 168.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.0 m -143.13 -28.83 0.55 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.555 1.542 . . . . 10.0 114.759 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.444 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 91.3 m-70 -103.49 -55.73 2.34 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.591 1.33 . . . . 10.0 114.591 -169.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m 35.11 84.35 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.593 2.757 . . . . 10.0 114.173 -168.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.63 -34.09 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.361 1.065 . . . . 10.0 112.545 164.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -95.1 154.8 17.0 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.921 0.711 . . . . 10.0 112.921 -156.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.8 mttp 50.98 -120.84 1.69 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.165 1.386 . . . . 10.0 110.485 176.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.261 0 C-N-CA 124.549 1.071 . . . . 10.0 112.405 172.713 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.444 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -129.15 172.05 19.81 Favored Glycine 0 CA--C 1.539 1.569 0 N-CA-C 109.525 -1.43 . . . . 10.0 109.525 152.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -71.65 163.58 38.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 120.286 2.043 . . . . 10.0 110.033 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.439 HD22 ' CD2' ' A' ' 33' ' ' HIS . 13.2 p30 -72.03 7.76 1.52 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.825 1.787 . . . . 10.0 115.825 -167.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mp 40.3 73.68 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.219 1.408 . . . . 10.0 111.587 -165.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.439 ' CD2' HD22 ' A' ' 31' ' ' ASN . 4.5 m80 -53.34 -164.51 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.894 2.878 . . . . 10.0 113.243 173.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.72 58.72 0.05 OUTLIER Glycine 0 CA--C 1.541 1.658 0 O-C-N 120.011 -1.681 . . . . 10.0 113.149 163.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tp -69.76 -38.47 76.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 128.679 2.792 . . . . 10.0 113.832 -161.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -66.21 95.95 0.32 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.457 1.503 . . . . 10.0 110.29 -175.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.72 13.85 9.99 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.225 1.393 . . . . 10.0 114.678 -173.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.6 ptm85 -150.64 -176.61 5.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.413 2.107 . . . . 10.0 114.74 -175.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -74.6 161.75 29.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.973 2.109 . . . . 10.0 113.837 -163.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.57 -34.74 25.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.56 1.944 . . . . 10.0 113.315 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.92 2.58 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 119.908 -1.745 . . . . 10.0 112.696 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.81 -5.01 1.05 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 118.057 2.614 . . . . 10.0 118.057 -168.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.92 113.75 27.86 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 125.807 1.643 . . . . 10.0 114.424 -167.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -79.22 57.25 6.39 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.552 3.501 . . . . 10.0 113.211 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.59 67.2 0.23 Allowed Glycine 0 N--CA 1.471 1.031 0 C-N-CA 124.527 1.061 . . . . 10.0 112.989 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -144.9 177.76 8.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.352 1.461 . . . . 10.0 109.255 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.2 t -152.77 123.85 7.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.271 1.028 . . . . 10.0 109.686 -177.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.19 172.48 18.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.492 1.517 . . . . 10.0 112.705 -159.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.4 p -74.81 107.12 6.7 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.541 -0.725 . . . . 10.0 110.902 177.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -75.21 83.35 2.38 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 122.489 1.138 . . . . 10.0 112.877 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -139.27 -46.21 0.46 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.096 1.758 . . . . 10.0 108.924 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -45.5 -67.04 0.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.373 2.269 . . . . 10.0 111.024 161.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.414 ' H ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -57.0 -49.33 76.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.265 0.939 . . . . 10.0 111.727 -178.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.69 -17.38 3.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.317 1.847 . . . . 10.0 115.012 173.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.16 60.08 0.29 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.345 0.975 . . . . 10.0 111.002 -169.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.06 -160.39 4.68 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.882 1.706 . . . . 10.0 115.527 173.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.3 pp -169.99 5.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 126.887 2.075 . . . . 10.0 112.698 -150.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.6 m 56.0 118.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.923 2.089 . . . . 10.0 113.645 -163.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -69.53 121.98 18.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.73 -1.231 . . . . 10.0 110.441 168.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -171.03 -179.05 2.63 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.349 1.859 . . . . 10.0 111.439 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -62.06 27.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 131.177 3.791 . . . . 10.0 115.46 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -160.07 9.28 0.1 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.254 2.222 . . . . 10.0 112.089 -167.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.2 p -157.71 -26.78 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.911 -1.118 . . . . 10.0 111.767 -165.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.8 -28.41 60.71 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 117.833 -1.079 . . . . 10.0 112.843 164.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -62.66 -54.3 41.5 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.684 1.129 . . . . 10.0 109.217 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 tp10 -64.07 -41.71 97.25 Favored 'General case' 0 N--CA 1.463 0.195 0 O-C-N 123.527 0.517 . . . . 10.0 110.017 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.64 -48.57 74.33 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.644 -0.693 . . . . 10.0 112.34 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -59.31 -53.96 52.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.288 1.403 . . . . 10.0 110.174 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.39 -18.63 63.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.883 1.438 . . . . 10.0 114.883 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.19 67.45 2.36 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 123.845 0.858 . . . . 10.0 111.803 -176.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.9 -63.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.576 2.851 . . . . 10.0 113.384 -164.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.56 -20.76 65.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.629 1.571 . . . . 10.0 113.473 -178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.88 -51.36 12.67 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.715 2.006 . . . . 10.0 111.275 168.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -60.35 -44.51 95.49 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.83 0.852 . . . . 10.0 112.767 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.34 133.59 20.65 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 124.005 0.922 . . . . 10.0 110.407 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.17 67.75 8.49 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.902 3.068 . . . . 10.0 113.9 -158.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -179.21 -115.31 0.46 Allowed Glycine 0 CA--C 1.524 0.617 0 C-N-CA 124.919 1.247 . . . . 10.0 110.037 167.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.254 36.9 m 67.85 155.89 0.11 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 128.989 2.915 . . . . 10.0 115.013 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mmtt -140.68 19.64 2.35 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.117 1.767 . . . . 10.0 112.601 -175.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.7 ttt -67.78 79.95 0.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.558 1.543 . . . . 10.0 111.398 166.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 71.7 mt -71.14 78.1 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 124.88 1.272 . . . . 10.0 109.87 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -164.09 -40.55 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.022 2.529 . . . . 10.0 110.501 170.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.98 -128.69 1.31 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.299 1.44 . . . . 10.0 112.945 -167.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.59 162.89 53.49 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-O 122.271 0.928 . . . . 10.0 115.131 -162.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.5 tp -80.83 3.91 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 113.757 1.021 . . . . 10.0 113.757 -168.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 62.4 0.65 0.63 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.571 2.348 . . . . 10.0 115.695 172.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -160.37 -144.97 0.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 129.983 3.313 . . . . 10.0 106.847 -163.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.64 -31.73 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 122.953 2.615 . . . . 10.0 117.888 -176.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -61.8 -34.52 76.06 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 121.604 2.002 . . . . 10.0 110.931 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 90' ' ' GLU . 1.4 pm0 -75.31 -4.43 39.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.914 2.485 . . . . 10.0 114.731 170.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.414 ' HA ' ' CZ ' ' A' ' 91' ' ' ARG . 1.4 tpm_? -72.45 -58.25 3.54 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 120.77 -1.206 . . . . 10.0 109.852 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -75.57 -29.7 59.42 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 117.076 -1.44 . . . . 10.0 114.29 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 9.6 p30 -65.06 -42.19 94.45 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.789 2.086 . . . . 10.0 112.7 177.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -55.54 -48.27 74.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.753 1.621 . . . . 10.0 112.532 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.7 mm -61.6 -48.1 90.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 118.872 -0.585 . . . . 10.0 109.642 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.3 91.07 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.638 0.775 . . . . 10.0 112.099 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -60.71 -61.93 2.23 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.846 1.258 . . . . 10.0 111.745 173.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.58 -39.73 94.64 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 118.131 -0.938 . . . . 10.0 112.029 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -16.14 63.2 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.694 1.133 . . . . 10.0 113.352 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -89.2 -58.43 2.54 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 124.24 1.016 . . . . 10.0 109.524 162.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.31 -19.1 32.18 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 115.776 1.769 . . . . 10.0 115.776 -173.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 p -65.71 -11.27 43.87 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.35 1.46 . . . . 10.0 114.589 167.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.98 -15.5 0.14 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.198 1.799 . . . . 10.0 115.028 -168.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 . . . . . 0 C--O 1.244 0.81 0 C-N-CA 126.389 1.875 . . . . 10.0 111.523 -170.132 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.988 0 CA-C-O 118.953 -0.915 . . . . 10.0 113.456 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.443 ' HB2' ' HE3' ' A' ' 5' ' ' LYS . 4.7 m-20 -135.34 139.96 44.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.651 1.58 . . . . 10.0 110.778 178.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.6 p -62.98 -43.66 99.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 -172.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.0 mp0 -61.74 -53.01 61.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.904 0.882 . . . . 10.0 110.795 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.443 ' HE3' ' HB2' ' A' ' 2' ' ' ASP . 4.3 mtmp? -60.88 -20.88 62.67 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.922 1.082 . . . . 10.0 113.922 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -91.58 -38.03 5.98 Favored Glycine 0 C--N 1.337 0.62 0 CA-C-N 119.129 0.877 . . . . 10.0 112.647 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -28.51 65.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.103 1.452 . . . . 10.0 112.473 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HZ1' ' CD ' ' A' ' 90' ' ' GLU . 1.6 pttm -60.92 -50.69 72.39 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.826 0.739 . . . . 10.0 111.629 172.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -67.11 -37.16 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 118.515 0.598 . . . . 10.0 110.864 178.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.429 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.8 t80 -55.7 -52.0 65.39 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-N 118.082 0.401 . . . . 10.0 110.541 170.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.4 t -65.95 -11.67 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -95.34 -32.47 12.94 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.89 1.276 . . . . 10.0 112.638 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -122.12 -56.98 1.8 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.883 1.273 . . . . 10.0 111.333 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.429 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 12.6 m -67.1 -51.52 53.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.864 1.666 . . . . 10.0 112.6 -171.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.46 -11.03 39.2 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 -172.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.57 -56.42 21.52 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.17 1.388 . . . . 10.0 109.531 166.196 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.3 m -85.25 -37.43 20.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.02 1.328 . . . . 10.0 112.556 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -120.82 44.89 2.37 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 127.079 2.152 . . . . 10.0 112.973 -163.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -57.86 125.19 21.98 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 119.872 -1.768 . . . . 10.0 111.537 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.78 -38.24 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-O 117.248 -1.358 . . . . 10.0 114.518 -168.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -11.84 37.81 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 121.46 1.936 . . . . 10.0 114.605 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -152.02 152.01 31.89 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 128.221 2.608 . . . . 10.0 107.944 167.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.236 0 C-N-CA 125.07 1.319 . . . . 10.0 114.504 177.25 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.49 159.0 19.99 Favored Glycine 0 CA--C 1.545 1.914 0 CA-C-N 120.941 1.7 . . . . 10.0 112.199 164.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.73 168.87 23.38 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 125.079 3.852 . . . . 10.0 113.537 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.51 123.41 19.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.63 -1.294 . . . . 10.0 108.336 162.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.74 93.27 0.1 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.303 1.041 . . . . 10.0 109.096 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -170.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.261 3.024 . . . . 10.0 113.448 -178.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.89 53.34 0.1 OUTLIER Glycine 0 CA--C 1.541 1.698 0 C-N-CA 126.424 1.964 . . . . 10.0 114.816 172.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mp -68.63 177.58 2.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 129.594 3.158 . . . . 10.0 112.931 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 64.18 59.7 1.03 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.232 1.813 . . . . 10.0 110.504 -166.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.17 16.84 0.26 Allowed Glycine 0 CA--C 1.535 1.283 0 N-CA-C 116.725 1.45 . . . . 10.0 116.725 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.0 ptm85 -152.88 168.78 24.64 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.326 2.063 . . . . 10.0 112.969 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.75 173.86 11.16 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.472 1.909 . . . . 10.0 113.554 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 77.6 p -69.65 172.57 7.24 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.583 1.953 . . . . 10.0 111.541 159.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.35 51.24 4.45 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.201 -0.937 . . . . 10.0 114.603 171.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -11.22 2.85 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.601 1.334 . . . . 10.0 114.601 -164.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.62 140.77 92.3 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 123.35 0.66 . . . . 10.0 112.036 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.03 63.38 8.74 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.558 2.838 . . . . 10.0 112.24 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.24 64.54 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.371 0.986 . . . . 10.0 114.978 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -67.32 170.36 7.38 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 118.424 1.112 . . . . 10.0 112.115 170.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.4 t -152.72 138.35 17.81 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.075 -1.015 . . . . 10.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 -96.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.464 1.506 . . . . 10.0 111.378 -154.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.2 p -142.24 136.89 30.29 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.599 1.559 . . . . 10.0 109.74 167.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.45 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -74.75 -31.05 61.69 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.087 -0.506 . . . . 10.0 112.339 177.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.26 -29.83 70.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.505 1.922 . . . . 10.0 113.299 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -72.8 -74.77 0.16 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.48 0.712 . . . . 10.0 109.542 160.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HZ3' ' CG ' ' A' ' 50' ' ' ASP 0.307 0.0 OUTLIER -60.24 -31.64 70.39 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.324 1.601 . . . . 10.0 115.324 -157.133 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.37 -22.89 65.55 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.876 1.435 . . . . 10.0 114.876 173.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.67 -36.29 83.22 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.582 1.083 . . . . 10.0 110.797 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.75 13.49 69.68 Favored Glycine 0 CA--C 1.533 1.165 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 165.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.4 pt -51.61 140.47 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 125.931 1.692 . . . . 10.0 111.85 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.1 m -76.13 108.53 9.11 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.418 0.628 . . . . 10.0 109.783 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -69.98 114.89 8.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.947 0.899 . . . . 10.0 111.33 173.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -163.85 -174.53 3.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.316 3.046 . . . . 10.0 109.294 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.22 -54.36 44.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.215 -0.928 . . . . 10.0 111.849 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -62.88 20.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.982 2.913 . . . . 10.0 115.467 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.4 p -158.37 -36.84 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.463 1.905 . . . . 10.0 111.228 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mp -73.92 -30.76 62.74 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 121.051 1.75 . . . . 10.0 112.642 166.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.1 ttm -64.27 -52.62 57.76 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.559 0.618 . . . . 10.0 109.487 175.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.65 -38.41 91.01 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.339 0.656 . . . . 10.0 110.647 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -64.21 -61.9 1.96 Allowed 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.451 -0.785 . . . . 10.0 112.323 175.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.0 tp -66.49 -30.11 70.37 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 120.323 1.42 . . . . 10.0 113.42 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -68.93 -24.49 64.29 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 119.01 0.823 . . . . 10.0 112.809 172.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.25 77.94 2.02 Favored Pre-proline 0 CA--C 1.556 1.208 0 N-CA-C 114.609 1.337 . . . . 10.0 114.609 172.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.79 -41.43 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 121.883 1.722 . . . . 10.0 112.143 -166.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.438 ' HE2' ' CB ' ' A' ' 83' ' ' ALA . 33.3 mttm -67.58 23.28 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.318 2.647 . . . . 10.0 114.777 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.4 mttm -161.36 -31.97 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.555 2.342 . . . . 10.0 111.932 -170.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -68.51 -31.63 71.02 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.276 0.944 . . . . 10.0 113.321 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 pt -135.81 151.84 74.82 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.889 1.276 . . . . 10.0 110.808 177.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.98 22.17 0.49 Allowed 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.29 3.326 . . . . 10.0 115.91 -159.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.4 100.47 0.17 Allowed Glycine 0 CA--C 1.524 0.638 0 O-C-N 121.206 -0.934 . . . . 10.0 112.663 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.32 -27.53 2.42 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.066 1.506 . . . . 10.0 115.066 -172.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.63 -70.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 116.566 -1.683 . . . . 10.0 112.831 -170.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.6 ttt 23.3 92.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 129.535 3.134 . . . . 10.0 113.914 -176.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.8 mt -70.31 70.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 125.741 1.616 . . . . 10.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -162.76 -70.16 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.458 1.903 . . . . 10.0 110.445 169.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.438 ' CB ' ' HE2' ' A' ' 72' ' ' LYS . . . 45.51 87.09 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.72 2.408 . . . . 10.0 116.732 171.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.65 93.63 2.26 Favored Glycine 0 C--N 1.341 0.843 0 C-N-CA 124.472 1.034 . . . . 10.0 111.181 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -66.54 156.24 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 122.34 1.067 . . . . 10.0 113.166 -175.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -59.98 -20.92 60.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.142 2.177 . . . . 10.0 115.356 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -161.51 133.84 5.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.998 2.119 . . . . 10.0 109.392 -165.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.75 -57.33 13.39 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.113 0.965 . . . . 10.0 112.79 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.4 m -50.72 -43.8 57.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.004 1.321 . . . . 10.0 112.278 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.47 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 60.0 mm-40 -59.41 -34.74 72.84 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.394 1.078 . . . . 10.0 112.734 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.3 ttp-105 -70.49 -34.19 72.09 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.127 1.33 . . . . 10.0 112.545 172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.35 -46.8 72.32 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 174.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.424 ' CG ' ' HZ1' ' A' ' 5' ' ' LYS . 68.1 m-20 -56.57 -52.12 66.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.602 1.561 . . . . 10.0 113.408 171.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 23.3 tp -53.12 -49.44 66.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.714 1.605 . . . . 10.0 113.521 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 12.1 mt -62.12 -39.28 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-O 119.176 -0.44 . . . . 10.0 110.685 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.44 87.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.562 0.619 . . . . 10.0 112.6 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -56.22 -56.3 22.62 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 117.841 -1.076 . . . . 10.0 111.281 169.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.14 -34.46 78.44 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 120.029 1.286 . . . . 10.0 112.37 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -59.42 -25.52 64.39 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 171.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -93.75 -62.06 1.43 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.741 1.616 . . . . 10.0 112.057 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.96 -11.17 12.03 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.803 1.779 . . . . 10.0 115.803 -164.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 p -81.27 -6.6 59.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -153.56 -10.45 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.187 1.795 . . . . 10.0 114.999 -169.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.249 1.046 0 C-N-CA 127.798 2.439 . . . . 10.0 110.725 -177.413 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 119.46 -0.633 . . . . 10.0 112.002 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -136.65 132.11 34.56 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.118 0.967 . . . . 10.0 111.159 -157.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.48 -54.96 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 125.428 1.491 . . . . 10.0 111.422 -167.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.22 -27.63 66.53 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 115.565 1.691 . . . . 10.0 115.565 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -64.23 -42.6 96.49 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.337 0.517 . . . . 10.0 109.611 163.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.56 -41.98 49.34 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 124.348 0.975 . . . . 10.0 111.377 -170.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -45.17 -59.62 2.54 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 126.987 2.115 . . . . 10.0 111.287 173.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -71.89 -42.3 66.95 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.314 1.046 . . . . 10.0 112.085 -172.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.84 -37.46 79.93 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 118.767 0.712 . . . . 10.0 111.351 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -56.02 -52.24 64.93 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 119.107 0.867 . . . . 10.0 110.107 167.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.5 t -61.36 -14.33 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -92.52 -38.51 11.89 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.472 1.509 . . . . 10.0 112.169 -177.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -130.23 0.09 4.61 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.769 1.766 . . . . 10.0 115.769 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.1 m -131.8 -43.48 0.99 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.241 1.417 . . . . 10.0 112.592 -176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.52 67.4 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.135 -0.978 . . . . 10.0 112.821 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -1.57 0.24 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.542 2.337 . . . . 10.0 114.791 170.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.3 m -143.16 -33.16 0.45 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.004 2.122 . . . . 10.0 112.468 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -115.25 -10.21 12.13 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.018 1.727 . . . . 10.0 115.271 -174.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 p 57.6 -68.17 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 128.661 2.784 . . . . 10.0 117.487 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.3 t 39.22 -96.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 128.954 2.902 . . . . 10.0 112.33 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -65.74 -17.46 64.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.472 1.109 . . . . 10.0 112.605 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -80.39 59.53 3.49 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.604 -1.31 . . . . 10.0 110.974 166.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.18 0 C-N-CA 126.1 1.81 . . . . 10.0 114.633 173.856 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.373 0.508 . . . . 10.0 112.373 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -132.8 173.86 20.74 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 125.583 1.563 . . . . 10.0 110.286 162.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.477 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 84.8 Cg_endo -72.21 161.22 45.17 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.36 2.04 . . . . 10.0 110.609 172.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.96 125.08 23.78 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.985 -1.072 . . . . 10.0 109.711 166.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -77.34 74.76 3.9 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 163.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -170.83 0.14 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 10.0 109.503 158.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -32.45 114.44 0.08 OUTLIER Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.13 0.871 . . . . 10.0 112.421 163.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 tp -136.56 -46.79 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.462 1.505 . . . . 10.0 112.054 -174.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -71.0 109.58 5.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.434 0.693 . . . . 10.0 109.953 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.25 4.29 90.25 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 118.661 -1.077 . . . . 10.0 113.865 -174.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mtp85 -81.45 -97.28 0.04 OUTLIER 'General case' 0 C--N 1.347 0.478 0 CA-C-O 116.946 -1.502 . . . . 10.0 109.087 169.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -152.42 -119.95 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 120.578 1.536 . . . . 10.0 110.744 174.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.6 m -148.7 165.85 30.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.468 3.107 . . . . 10.0 106.967 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 68.46 -3.58 5.95 Favored Glycine 0 CA--C 1.529 0.917 0 N-CA-C 118.763 2.265 . . . . 10.0 118.763 156.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.23 125.38 26.5 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.603 1.961 . . . . 10.0 111.236 174.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.71 157.38 16.33 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.88 1.672 . . . . 10.0 108.732 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -83.84 -119.24 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 124.005 3.137 . . . . 10.0 109.897 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.99 74.8 0.95 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.915 1.245 . . . . 10.0 113.084 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.477 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 51.0 t80 -144.56 107.24 4.43 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.019 1.327 . . . . 10.0 111.791 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.5 m -79.77 95.32 5.96 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.773 1.229 . . . . 10.0 111.539 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.05 173.19 11.32 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.356 0.872 . . . . 10.0 113.356 169.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.4 p -69.31 -5.05 20.66 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 128.66 2.784 . . . . 10.0 115.616 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 t70 47.42 -169.46 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.384 1.874 . . . . 10.0 114.046 -159.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.23 -42.82 0.1 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.374 3.07 . . . . 10.0 115.307 -166.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -61.29 2.72 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.838 1.255 . . . . 10.0 111.079 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -43.23 55.18 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 127.315 2.246 . . . . 10.0 112.375 168.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -18.22 65.19 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 115.447 1.647 . . . . 10.0 115.447 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.96 -32.29 61.68 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.093 0.86 . . . . 10.0 111.174 170.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.17 28.43 73.68 Favored Glycine 0 CA--C 1.537 1.466 0 N-CA-C 116.277 1.271 . . . . 10.0 116.277 162.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -7.55 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 127.343 2.257 . . . . 10.0 116.584 -173.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.4 m 57.62 108.47 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.695 2.398 . . . . 10.0 114.384 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -66.62 135.07 53.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.18 1.392 . . . . 10.0 110.624 172.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 163.23 -72.5 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 129.875 3.27 . . . . 10.0 107.692 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -44.82 -61.77 1.47 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.548 1.939 . . . . 10.0 111.477 -178.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 2.3 p -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 127.611 2.364 . . . . 10.0 112.22 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -32.92 60.23 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.105 0.962 . . . . 10.0 113.449 177.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 6.8 ttm -62.83 -52.9 61.35 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 170.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -64.97 -38.19 90.15 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.226 1.41 . . . . 10.0 111.025 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -60.83 -64.09 1.08 Allowed 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.208 1.003 . . . . 10.0 110.716 170.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.72 -32.15 68.94 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.611 1.096 . . . . 10.0 112.67 -175.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.4 -35.33 69.89 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.669 1.359 . . . . 10.0 114.669 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -162.39 80.49 1.81 Allowed Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 119.811 1.187 . . . . 10.0 111.543 173.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.7 -44.68 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.413 2.076 . . . . 10.0 112.174 -160.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -60.14 -34.78 74.02 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 127.209 2.204 . . . . 10.0 113.359 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -76.3 -41.41 48.71 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 119.061 -0.495 . . . . 10.0 111.489 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -69.88 -39.25 76.4 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.649 1.351 . . . . 10.0 114.649 -171.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 21.0 pt -135.17 144.02 48.25 Favored Pre-proline 0 N--CA 1.473 0.696 0 CA-C-N 118.811 0.732 . . . . 10.0 111.458 172.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -69.3 163.87 36.28 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.192 2.594 . . . . 10.0 111.083 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.15 -22.82 0.16 Allowed Glycine 0 CA--C 1.535 1.323 0 N-CA-C 116.344 1.298 . . . . 10.0 116.344 176.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.73 118.63 5.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 120.053 1.926 . . . . 10.0 109.745 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -87.12 -71.08 0.58 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.871 0.868 . . . . 10.0 110.683 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.4 ttp 28.61 101.17 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 129.892 3.277 . . . . 10.0 113.987 -176.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.6 tp -64.2 54.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 128.871 2.868 . . . . 10.0 114.407 -174.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -163.4 -176.08 4.56 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.542 2.337 . . . . 10.0 110.697 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.51 -155.82 0.34 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.867 2.467 . . . . 10.0 109.763 -173.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.68 44.06 0.15 Allowed Glycine 0 CA--C 1.536 1.354 0 C-N-CA 128.193 2.806 . . . . 10.0 117.656 -170.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.429 HG23 ' H ' ' A' ' 86' ' ' LYS 0.368 7.4 tt 42.96 -112.19 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 128.833 2.853 . . . . 10.0 113.036 -177.45 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.429 ' H ' HG23 ' A' ' 85' ' ' ILE . 53.9 tttm -149.7 -69.65 0.2 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.157 1.799 . . . . 10.0 113.259 173.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.74 148.04 36.96 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.486 1.039 . . . . 10.0 110.684 173.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -58.55 -36.84 74.52 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.11 -0.369 . . . . 10.0 111.619 169.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 m -55.94 -53.81 52.3 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 124.774 1.23 . . . . 10.0 110.062 176.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -57.76 -39.4 77.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.832 0.853 . . . . 10.0 111.771 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -50.51 73.76 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 118.764 -0.636 . . . . 10.0 111.709 175.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -58.19 -52.63 64.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.392 1.077 . . . . 10.0 111.539 172.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -55.81 -47.78 76.56 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 126.841 2.056 . . . . 10.0 111.465 -170.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.56 -43.8 93.48 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.4 mm -65.45 -44.26 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 118.948 -0.549 . . . . 10.0 110.528 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.38 85.74 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.649 0.779 . . . . 10.0 112.163 175.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -57.21 -55.07 39.54 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.061 1.344 . . . . 10.0 111.443 171.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.29 -34.7 78.25 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 118.436 -0.792 . . . . 10.0 112.618 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -59.98 -20.79 59.54 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.941 1.296 . . . . 10.0 113.462 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -92.87 -50.68 5.44 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.73 1.212 . . . . 10.0 112.196 165.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.04 -22.85 63.17 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 120.21 1.368 . . . . 10.0 114.567 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.6 t -76.55 6.4 5.89 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.586 1.954 . . . . 10.0 114.489 169.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -151.37 -42.35 0.12 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.855 1.662 . . . . 10.0 113.685 -166.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 115.987 -1.959 . . . . 10.0 115.224 -179.184 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.608 -1.106 . . . . 10.0 113.51 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -118.12 154.5 32.02 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.776 1.63 . . . . 10.0 112.143 166.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.92 -52.15 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.21 1.404 . . . . 10.0 111.886 171.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -47.36 71.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 124.277 1.031 . . . . 10.0 113.469 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.58 -15.66 58.72 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.961 0.8 . . . . 10.0 112.204 172.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.21 -48.96 3.4 Favored Glycine 0 C--N 1.34 0.773 0 C-N-CA 125.224 1.393 . . . . 10.0 112.318 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -35.12 79.6 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 122.264 -0.55 . . . . 10.0 112.478 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -39.18 90.01 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.441 0.904 . . . . 10.0 113.441 174.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -33.89 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.615 1.098 . . . . 10.0 111.079 175.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -55.98 -52.07 65.49 Favored 'General case' 0 C--N 1.342 0.244 0 O-C-N 121.435 -0.791 . . . . 10.0 110.454 167.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.9 t -63.67 -11.41 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 113.632 0.975 . . . . 10.0 113.632 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -85.32 -48.0 9.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.271 1.028 . . . . 10.0 111.337 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -136.07 4.85 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 -168.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.5 m -116.74 -41.6 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.439 1.496 . . . . 10.0 111.215 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.64 -27.07 57.66 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.538 0.94 . . . . 10.0 113.538 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -55.34 -15.21 2.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.882 2.073 . . . . 10.0 115.571 172.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 69.4 m -142.09 -14.32 0.8 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.237 1.415 . . . . 10.0 112.673 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -128.44 -13.45 4.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.845 1.424 . . . . 10.0 114.845 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.3 t 39.46 11.62 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 120.352 3.464 . . . . 10.0 120.352 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.0 p -63.82 -16.02 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 N-CA-C 117.053 2.242 . . . . 10.0 117.053 -160.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.03 6.83 4.71 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.251 1.387 . . . . 10.0 112.443 169.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -152.02 -173.26 4.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.188 2.995 . . . . 10.0 107.941 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.168 0 O-C-N 121.057 -1.027 . . . . 10.0 112.113 179.472 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -134.68 148.46 19.53 Favored Glycine 0 CA--C 1.547 2.065 0 CA-C-N 121.902 2.137 . . . . 10.0 113.724 165.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -82.27 68.08 7.89 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.064 3.176 . . . . 10.0 112.395 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.446 HD22 ' CD2' ' A' ' 33' ' ' HIS . 11.6 p30 47.73 -11.46 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.495 1 N-CA-C 122.121 4.119 . . . . 10.0 122.121 157.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . 0.315 5.0 mp 55.28 37.37 28.8 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 128.755 2.822 . . . . 10.0 117.158 -175.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.446 ' CD2' HD22 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -52.67 108.22 0.29 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.945 1.698 . . . . 10.0 113.954 164.103 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.27 35.17 49.42 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 116.187 1.235 . . . . 10.0 116.187 158.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.78 -175.85 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 126.505 1.922 . . . . 10.0 111.696 168.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 60.39 64.97 1.12 Allowed 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.336 -1.478 . . . . 10.0 112.855 -173.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.59 -35.28 2.51 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.591 2.043 . . . . 10.0 112.886 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.477 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -66.79 154.41 40.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.335 1.054 . . . . 10.0 110.488 169.469 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -62.87 177.97 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.875 1.67 . . . . 10.0 111.963 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.71 156.17 31.25 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.12 -0.988 . . . . 10.0 109.731 158.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 43' ' ' ALA . . . 78.44 -116.21 4.35 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.249 -0.907 . . . . 10.0 112.926 169.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 54.64 -7.38 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.268 2.227 . . . . 10.0 116.766 -172.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 41' ' ' GLY . . . -57.42 158.59 10.51 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.327 2.651 . . . . 10.0 113.349 176.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.53 -175.25 1.04 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.144 2.562 . . . . 10.0 111.002 161.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.99 28.36 0.07 OUTLIER Glycine 0 CA--C 1.541 1.688 0 C-N-CA 127.492 2.472 . . . . 10.0 118.015 -173.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.27 128.06 34.16 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.917 1.687 . . . . 10.0 109.707 166.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 m -73.46 125.04 27.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.175 0.99 . . . . 10.0 112.489 -174.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.431 ' HB2' ' HZ1' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -140.08 178.15 7.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.536 1.934 . . . . 10.0 112.572 -175.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.0 p -85.93 106.24 16.98 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.169 0.895 . . . . 10.0 110.856 166.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -56.29 -29.49 61.25 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.863 1.801 . . . . 10.0 115.863 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.82 -54.94 31.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.87 1.268 . . . . 10.0 112.094 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -47.27 -55.98 7.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.746 1.618 . . . . 10.0 111.82 174.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HZ1' ' HB2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -57.0 -57.25 13.35 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.571 0.748 . . . . 10.0 110.924 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -65.6 -22.74 66.7 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.489 0.922 . . . . 10.0 113.489 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -20.99 66.38 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.135 0.88 . . . . 10.0 112.858 171.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.06 11.58 63.89 Favored Glycine 0 CA--C 1.535 1.336 0 N-CA-C 116.076 1.191 . . . . 10.0 116.076 164.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.28 -6.29 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 128.643 2.777 . . . . 10.0 117.236 -171.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 84.9 m 58.38 117.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.65 2.78 . . . . 10.0 115.665 171.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 21.6 m95 -76.0 120.73 21.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.861 -1.063 . . . . 10.0 112.644 -175.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.37 179.21 5.12 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.262 2.225 . . . . 10.0 110.605 -176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.402 ' CD ' ' HZ1' ' A' ' 99' ' ' LYS . 2.7 tt0 -69.75 -13.24 62.18 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.248 1.419 . . . . 10.0 114.754 -169.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.02 -58.61 3.18 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.505 1.145 . . . . 10.0 111.406 163.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.6 p -75.19 -37.32 61.25 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.728 1.611 . . . . 10.0 112.882 -165.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.02 -11.71 59.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.965 1.306 . . . . 10.0 113.938 172.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -65.95 0.61 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 106.878 -1.527 . . . . 10.0 106.878 158.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -45.53 70.56 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.431 1.092 . . . . 10.0 111.332 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -66.64 -56.05 12.46 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.463 0.912 . . . . 10.0 113.463 -177.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -27.5 65.62 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.584 1.538 . . . . 10.0 112.36 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -66.55 -38.06 86.31 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 120.197 1.362 . . . . 10.0 114.227 169.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -162.81 100.13 1.06 Allowed Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 119.885 1.221 . . . . 10.0 111.672 166.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.69 -46.48 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.271 1.981 . . . . 10.0 111.493 -168.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -70.03 -22.36 63.1 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.224 1.81 . . . . 10.0 113.293 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -72.44 -53.93 10.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.716 0.806 . . . . 10.0 110.43 163.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -58.99 -41.0 86.54 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.42 155.27 64.28 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 124.228 1.011 . . . . 10.0 111.852 170.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.36 150.6 52.78 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.56 2.173 . . . . 10.0 113.193 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.87 -100.44 2.52 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.089 2.28 . . . . 10.0 111.208 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.289 96.9 m 34.65 90.43 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 130.731 3.612 . . . . 10.0 116.058 -176.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -73.31 19.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.853 1.427 . . . . 10.0 114.853 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.5 ttt -70.29 78.16 0.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.158 -0.964 . . . . 10.0 108.932 164.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 25.9 mm -69.51 78.56 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 125.0 1.32 . . . . 10.0 109.654 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -162.73 -72.42 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.52 1.128 . . . . 10.0 111.935 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -70.6 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.268 2.627 . . . . 10.0 116.439 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.17 86.78 0.11 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 126.621 2.058 . . . . 10.0 113.828 -166.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 tt -63.28 -53.99 38.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 115.108 1.521 . . . . 10.0 115.108 -163.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 163.58 -169.8 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 1 C-N-CA 131.821 4.049 . . . . 10.0 109.138 -175.742 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.409 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.64 -70.21 0.11 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.924 2.489 . . . . 10.0 114.207 -162.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.71 -51.5 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.502 1.297 . . . . 10.0 114.502 -173.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -46.87 88.26 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.439 1.018 . . . . 10.0 110.525 -175.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -60.27 -33.71 72.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.937 1.695 . . . . 10.0 112.179 -172.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.9 -43.94 97.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.009 2.124 . . . . 10.0 112.476 172.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.71 -43.44 65.9 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.896 1.278 . . . . 10.0 110.565 174.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -58.24 -44.09 88.13 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.689 1.196 . . . . 10.0 110.376 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.61 -47.63 66.85 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.229 1.196 . . . . 10.0 114.229 171.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.94 -47.22 89.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.62 82.16 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.648 0.779 . . . . 10.0 112.319 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -65.01 -63.23 1.16 Allowed 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.611 1.164 . . . . 10.0 112.017 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.43 -33.27 75.56 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.262 -0.875 . . . . 10.0 112.419 -170.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.402 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 15.8 tptm -62.55 -14.48 42.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.642 1.177 . . . . 10.0 113.311 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -95.29 -58.95 2.0 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.421 1.089 . . . . 10.0 110.952 161.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.81 -16.63 17.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 116.429 2.011 . . . . 10.0 116.429 -168.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.5 p -74.96 -4.54 38.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.844 1.424 . . . . 10.0 114.844 168.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -153.32 -22.24 0.15 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.062 1.745 . . . . 10.0 114.465 -167.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 C--O 1.249 1.035 0 C-N-CA 126.872 2.069 . . . . 10.0 111.059 -160.933 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.667 0 CA-C-O 118.924 -0.931 . . . . 10.0 112.326 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.07 140.93 36.22 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.087 0.944 . . . . 10.0 112.816 -149.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -55.35 -50.05 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.837 2.055 . . . . 10.0 113.223 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mp0 -64.44 -32.94 74.77 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.373 -0.829 . . . . 10.0 111.639 -174.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -76.02 -12.38 60.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.031 1.732 . . . . 10.0 112.842 172.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.75 -48.01 3.53 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 124.21 0.91 . . . . 10.0 111.269 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -49.98 -44.34 50.79 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.161 0.98 . . . . 10.0 112.831 174.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.402 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -67.26 -12.86 61.21 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.883 1.673 . . . . 10.0 114.328 -177.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.402 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 8.1 tp -114.78 -28.03 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.689 0.796 . . . . 10.0 112.204 174.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -55.58 -52.91 62.17 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.224 1.01 . . . . 10.0 110.456 163.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.33 -12.8 9.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.936 0.717 . . . . 10.0 112.936 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.25 -70.23 0.72 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.919 1.288 . . . . 10.0 109.43 172.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -80.48 -11.14 59.71 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.228 1.566 . . . . 10.0 115.228 -168.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 m -124.46 -48.13 1.83 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.649 1.179 . . . . 10.0 111.735 -171.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.31 -13.2 57.94 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.658 0.985 . . . . 10.0 113.658 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -55.35 -14.15 1.74 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.858 1.663 . . . . 10.0 114.143 162.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.3 m -142.74 -25.03 0.63 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.803 2.041 . . . . 10.0 113.134 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.41 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 81.9 m-70 -126.74 77.17 1.7 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 127.145 2.178 . . . . 10.0 112.154 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 t -75.17 46.52 0.32 Allowed 'General case' 0 CA--C 1.557 1.249 0 O-C-N 120.182 -1.574 . . . . 10.0 114.494 -175.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.72 -51.46 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.802 1.641 . . . . 10.0 113.218 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -53.42 -45.26 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.719 1.208 . . . . 10.0 111.52 -171.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -86.17 7.24 25.8 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.63 1.572 . . . . 10.0 113.198 -176.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.08 0 C-N-CA 124.535 1.064 . . . . 10.0 114.521 175.411 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.72 167.36 16.32 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 123.835 0.731 . . . . 10.0 111.904 169.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 45.7 Cg_endo -68.3 166.3 25.81 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.27 3.313 . . . . 10.0 110.921 169.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -85.19 139.97 31.26 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.664 -1.235 . . . . 10.0 107.664 164.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.7 74.8 5.22 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.587 -0.894 . . . . 10.0 108.587 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 73.66 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.557 3.143 . . . . 10.0 113.159 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.27 -68.73 0.06 OUTLIER Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.506 2.479 . . . . 10.0 111.443 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.406 ' C ' HH11 ' A' ' 38' ' ' ARG 0.288 6.9 tp 112.06 -122.79 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.483 1 C-N-CA 132.529 4.331 . . . . 10.0 109.322 167.002 . . . . . . . . 4 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 32.72 64.81 0.25 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.731 2.412 . . . . 10.0 116.731 167.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.25 -42.24 1.73 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.915 2.198 . . . . 10.0 115.023 172.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.406 HH11 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -64.62 11.0 0.06 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 120.363 3.468 . . . . 10.0 120.363 -158.567 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.9 mttt 79.03 147.2 0.09 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.527 3.131 . . . . 10.0 113.379 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -71.78 -40.65 69.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.605 1.562 . . . . 10.0 111.949 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.0 56.66 1.43 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 126.223 1.868 . . . . 10.0 113.251 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -129.95 -22.75 2.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 -173.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.18 105.13 0.48 Allowed Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 126.067 1.747 . . . . 10.0 113.538 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -79.97 62.32 8.48 Favored 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.11 3.207 . . . . 10.0 114.085 -163.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.13 60.63 0.18 Allowed Glycine 0 N--CA 1.471 1.027 0 C-N-CA 124.891 1.234 . . . . 10.0 112.341 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.406 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 34.1 t80 -143.63 170.75 15.25 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.545 1.538 . . . . 10.0 109.748 -169.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.6 t -152.84 153.6 33.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 122.08 0.943 . . . . 10.0 110.946 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -155.26 -105.14 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.737 -1.119 . . . . 10.0 110.369 -150.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 50.3 p -141.78 9.44 1.97 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.352 1.061 . . . . 10.0 112.859 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 48.95 -50.14 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.553 3.141 . . . . 10.0 115.009 -159.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.47 -41.22 9.24 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.725 2.01 . . . . 10.0 113.192 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -48.57 -60.9 2.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.514 1.526 . . . . 10.0 112.843 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -33.7 61.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.171 0.988 . . . . 10.0 112.12 179.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.71 -32.8 74.34 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.429 1.092 . . . . 10.0 113.488 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -50.58 73.51 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.898 0.772 . . . . 10.0 110.357 172.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.84 128.54 0.55 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 123.46 0.553 . . . . 10.0 113.59 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -170.71 13.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 126.952 2.101 . . . . 10.0 112.375 -162.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.6 m 44.92 56.58 5.23 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.303 1.441 . . . . 10.0 114.238 152.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -52.43 135.82 32.73 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -163.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -177.72 -167.47 0.15 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 130.702 3.601 . . . . 10.0 110.579 -168.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -68.74 32.81 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.301 2.641 . . . . 10.0 116.713 -159.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.21 -57.67 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.392 -1.442 . . . . 10.0 111.784 -169.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.4 p -53.63 -44.54 69.62 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 130.942 3.697 . . . . 10.0 111.479 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.9 mp -65.18 -32.98 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.436 1.016 . . . . 10.0 113.37 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.9 mtm -75.24 -25.99 58.53 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 120.116 1.325 . . . . 10.0 111.84 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -75.52 -47.58 26.3 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 118.929 0.786 . . . . 10.0 111.708 162.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.68 -43.33 89.61 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 114.009 1.114 . . . . 10.0 114.009 -173.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -64.36 -41.35 96.78 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.326 1.421 . . . . 10.0 111.68 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -68.6 -28.76 67.21 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.902 1.075 . . . . 10.0 113.902 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -161.34 86.88 1.66 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.731 1.212 . . . . 10.0 111.276 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.07 -48.17 5.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.355 2.037 . . . . 10.0 113.694 -169.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -69.98 -19.36 63.35 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.177 1.391 . . . . 10.0 113.036 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.38 -47.75 46.97 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.493 1.117 . . . . 10.0 110.191 167.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -71.98 -40.75 68.35 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.643 0.979 . . . . 10.0 113.643 -174.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.0 pt -135.79 126.7 16.98 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.345 1.058 . . . . 10.0 109.324 170.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -70.77 148.84 59.41 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.455 2.103 . . . . 10.0 111.261 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 47.37 66.75 1.76 Allowed Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.066 1.317 . . . . 10.0 113.124 176.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.2 t -123.61 23.27 8.89 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.216 1.406 . . . . 10.0 113.918 -169.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt 47.83 -88.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.181 2.192 . . . . 10.0 113.631 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt 15.21 90.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 131.019 3.728 . . . . 10.0 113.82 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.436 ' H ' HD11 ' A' ' 81' ' ' ILE . 2.6 mp -74.52 54.89 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 126.733 2.013 . . . . 10.0 110.139 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -163.28 66.63 0.19 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.411 1.885 . . . . 10.0 109.709 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.39 112.19 11.45 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.157 0.983 . . . . 10.0 110.408 172.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.26 175.13 32.99 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.766 1.204 . . . . 10.0 113.612 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -143.92 149.47 17.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.317 -1.364 . . . . 10.0 107.317 157.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -66.83 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.277 1.031 . . . . 10.0 113.185 -166.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -77.05 120.99 22.92 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.037 -1.097 . . . . 10.0 108.037 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -63.66 -16.46 61.04 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.073 1.306 . . . . 10.0 113.999 -174.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 m -55.48 -34.94 65.0 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.948 . . . . 10.0 112.421 163.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.19 -38.63 88.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.97 1.308 . . . . 10.0 111.181 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -60.87 -50.71 72.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.626 1.17 . . . . 10.0 110.938 175.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.56 -53.16 61.52 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.459 1.103 . . . . 10.0 111.886 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -56.66 -44.09 81.02 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.315 1.446 . . . . 10.0 110.617 -175.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mp -60.32 -45.65 92.65 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.189 1.181 . . . . 10.0 114.189 175.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mm -61.04 -48.59 88.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.91 73.68 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.76 0.424 . . . . 10.0 111.549 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -51.46 -59.1 4.62 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.792 1.637 . . . . 10.0 112.754 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 48.1 mt -68.45 -36.08 78.51 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.224 0.92 . . . . 10.0 112.15 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -32.46 74.02 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.654 0.661 . . . . 10.0 112.302 178.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.473 ' HZ3' ' CD ' ' A' ' 104' ' ' GLU . 3.0 mmmp? -72.8 -52.6 14.3 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.333 1.453 . . . . 10.0 112.242 165.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.79 -27.98 45.59 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.898 1.444 . . . . 10.0 114.898 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.6 t -76.49 2.78 12.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 115.643 1.719 . . . . 10.0 115.643 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -151.32 -1.84 0.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.026 1.491 . . . . 10.0 115.026 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.473 ' CD ' ' HZ3' ' A' ' 100' ' ' LYS . 10.1 tp10 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 127.525 2.33 . . . . 10.0 114.488 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.179 -0.768 . . . . 10.0 111.179 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.53 135.16 49.96 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.423 0.689 . . . . 10.0 112.645 -155.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.28 -50.61 70.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 125.749 1.62 . . . . 10.0 111.438 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.83 -40.1 87.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.681 1.592 . . . . 10.0 114.084 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.79 -26.48 68.37 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.751 0.82 . . . . 10.0 112.514 169.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.54 -52.02 4.64 Favored Glycine 0 C--N 1.335 0.499 0 N-CA-C 110.281 -1.128 . . . . 10.0 110.281 -178.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.23 38.7 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.769 2.027 . . . . 10.0 114.709 176.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -42.16 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.713 2.405 . . . . 10.0 110.988 175.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 tp -74.83 -33.96 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 119.796 1.18 . . . . 10.0 111.426 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -56.25 -51.12 69.29 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-O 121.25 0.548 . . . . 10.0 109.889 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.7 t -65.19 -9.43 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.543 0.737 . . . . 10.0 112.539 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -94.56 -58.59 2.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.436 1.494 . . . . 10.0 111.038 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -116.99 8.74 13.49 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 116.236 1.939 . . . . 10.0 116.236 -168.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.8 m -118.81 -46.55 2.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.074 1.35 . . . . 10.0 110.842 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.02 62.58 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.05 1.13 . . . . 10.0 114.05 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.28 -12.12 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.757 1.223 . . . . 10.0 114.146 165.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.8 m -143.22 -17.57 0.65 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.083 1.753 . . . . 10.0 114.091 -176.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -132.51 102.07 5.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.699 2.0 . . . . 10.0 112.731 -175.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -67.15 24.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 128.988 2.915 . . . . 10.0 116.943 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.8 p -64.58 -39.33 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 120.404 -1.435 . . . . 10.0 114.483 -168.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -59.9 -14.45 15.53 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.011 1.724 . . . . 10.0 115.064 -160.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -150.31 13.05 0.75 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.1 2.16 . . . . 10.0 110.83 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.382 0 C-N-CA 125.74 1.638 . . . . 10.0 113.92 -168.309 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.1 m . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.977 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.69 -174.28 25.82 Favored Glycine 0 CA--C 1.541 1.71 0 N-CA-C 110.402 -1.079 . . . . 10.0 110.402 150.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -65.92 173.83 6.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.639 2.226 . . . . 10.0 110.267 168.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.574 HD22 ' CD2' ' A' ' 33' ' ' HIS . 13.7 p30 -74.01 0.71 12.8 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.391 1.477 . . . . 10.0 112.87 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.47 28.23 15.16 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.429 2.292 . . . . 10.0 114.77 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.615 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -53.74 157.42 2.31 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.826 1.25 . . . . 10.0 112.613 168.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.23 8.69 3.62 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 127.821 2.629 . . . . 10.0 118.787 149.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.436 ' CD2' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -73.17 -173.86 1.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.603 1.702 . . . . 10.0 114.001 -177.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 60.58 48.39 7.47 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.813 1.645 . . . . 10.0 110.367 -152.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 146.06 -17.38 1.74 Allowed Glycine 0 CA--C 1.545 1.927 0 N-CA-C 117.921 1.928 . . . . 10.0 117.921 176.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.615 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 16.2 ttp180 -63.58 3.92 0.3 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.708 2.484 . . . . 10.0 117.708 -165.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.279 0.0 OUTLIER 70.58 -0.76 2.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.944 2.497 . . . . 10.0 116.615 -170.185 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.293 13.8 t 52.47 -43.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 129.585 3.154 . . . . 10.0 116.217 -165.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.85 76.23 0.01 OUTLIER Glycine 0 CA--C 1.534 1.221 0 C-N-CA 126.468 1.985 . . . . 10.0 112.828 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -168.1 123.0 0.97 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.327 2.251 . . . . 10.0 111.203 -175.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.92 119.02 0.97 Allowed Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.149 1.379 . . . . 10.0 109.394 169.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 69.5 2.9 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.678 2.919 . . . . 10.0 112.134 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.12 75.59 1.25 Allowed Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.215 1.864 . . . . 10.0 112.962 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -146.56 179.88 7.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.442 1.497 . . . . 10.0 109.658 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 94.2 m -154.79 88.76 1.2 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.737 1.215 . . . . 10.0 108.838 171.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.485 1.514 . . . . 10.0 110.87 169.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.418 ' HG1' ' ND2' ' A' ' 52' ' ' ASN . 52.4 p -75.19 71.46 2.22 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.149 0.98 . . . . 10.0 110.909 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -55.97 -12.87 1.57 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.215 2.206 . . . . 10.0 116.112 -161.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.33 -26.65 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.452 -1.405 . . . . 10.0 113.141 165.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.418 ' ND2' ' HG1' ' A' ' 49' ' ' THR . 17.2 p30 -78.14 -67.86 0.69 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.345 1.979 . . . . 10.0 116.345 159.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.51 -39.27 48.15 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.134 1.333 . . . . 10.0 113.248 -174.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -19.99 65.5 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.445 1.498 . . . . 10.0 114.043 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -66.92 -27.34 67.41 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.928 1.695 . . . . 10.0 111.648 168.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.79 12.13 64.1 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 115.619 1.007 . . . . 10.0 115.619 168.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -53.82 -10.17 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 127.655 2.382 . . . . 10.0 115.882 -174.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 88.8 m 57.38 128.61 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 130.122 3.369 . . . . 10.0 115.511 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -75.76 145.8 40.51 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.18 -0.918 . . . . 10.0 112.973 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 175.33 175.18 0.23 Allowed 'General case' 0 CA--C 1.538 0.487 1 C-N-CA 133.33 4.652 . . . . 10.0 106.035 -179.421 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.469 ' CD ' ' HZ1' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -51.79 -30.39 22.83 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.517 1.302 . . . . 10.0 114.517 177.223 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -75.43 5.65 5.54 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.978 2.214 . . . . 10.0 116.978 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.2 p -160.53 -31.07 0.06 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.968 1.307 . . . . 10.0 111.706 -171.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 -19.67 58.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.5 1.046 . . . . 10.0 112.468 171.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -60.82 3.19 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 162.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -53.4 -45.71 69.41 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 127.741 2.416 . . . . 10.0 110.124 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -73.47 -46.91 45.34 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 117.867 -1.063 . . . . 10.0 113.371 -178.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.24 -39.78 95.6 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.969 1.713 . . . . 10.0 111.699 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -65.16 -32.5 74.22 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.578 1.081 . . . . 10.0 113.411 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.15 77.05 1.82 Allowed Pre-proline 0 CA--C 1.558 1.271 0 CA-C-N 119.858 1.208 . . . . 10.0 111.802 -175.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.14 -54.81 0.35 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.112 1.875 . . . . 10.0 112.905 -160.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -64.58 -23.03 67.13 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.322 1.849 . . . . 10.0 113.596 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -77.21 -47.44 20.22 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.622 1.169 . . . . 10.0 111.758 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.89 -45.0 94.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.1 pt -136.65 145.94 53.32 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.838 0.855 . . . . 10.0 111.697 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.76 161.04 40.04 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 122.994 2.463 . . . . 10.0 113.266 -168.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.22 -25.16 0.26 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 126.328 1.918 . . . . 10.0 116.84 171.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.8 m -36.68 115.63 0.38 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.18 2.592 . . . . 10.0 114.674 -165.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -86.44 6.66 29.26 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.088 1.514 . . . . 10.0 115.088 177.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.4 ttt -60.4 92.13 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.625 -0.672 . . . . 10.0 109.416 158.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.2 tt -68.06 -17.84 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 122.7 1.238 . . . . 10.0 113.656 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -75.28 78.45 2.38 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.366 2.266 . . . . 10.0 110.728 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.08 59.79 0.18 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.786 1.634 . . . . 10.0 113.193 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.9 -166.12 29.8 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.456 1.503 . . . . 10.0 113.955 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -142.07 155.64 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.951 1.301 . . . . 10.0 109.439 -171.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -67.37 -78.4 0.06 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.158 1.783 . . . . 10.0 113.793 -153.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -76.43 106.75 8.24 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.51 -12.09 2.45 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 116.556 2.058 . . . . 10.0 116.556 -167.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 m -57.68 -40.28 79.05 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.269 1.428 . . . . 10.0 112.798 161.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.88 -35.27 66.32 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.458 1.503 . . . . 10.0 110.863 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.84 2.58 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.59 1.956 . . . . 10.0 114.312 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -157.18 -5.4 0.1 Allowed 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.043 1.337 . . . . 10.0 113.5 -174.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -57.21 -47.67 80.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 140.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.58 -49.47 72.64 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.71 1.604 . . . . 10.0 114.577 170.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 11.2 mm -60.0 -46.43 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.54 83.83 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.184 0.994 . . . . 10.0 112.423 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -58.7 7.39 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.657 1.183 . . . . 10.0 112.083 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.88 -31.6 72.63 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.038 0.836 . . . . 10.0 112.799 -174.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.469 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 30.4 ttpt -64.29 -17.98 64.15 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.483 0.92 . . . . 10.0 113.483 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -92.32 -56.17 3.14 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.568 -1.206 . . . . 10.0 110.273 163.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.12 32.96 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.58 1.696 . . . . 10.0 115.58 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.4 t -68.21 -19.01 64.73 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.692 1.368 . . . . 10.0 114.692 168.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.34 -0.78 0.23 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 116.467 2.025 . . . . 10.0 116.467 -166.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 126.8 2.04 . . . . 10.0 110.611 -171.28 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 110.429 -1.068 . . . . 10.0 110.429 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.96 148.01 44.67 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.327 1.851 . . . . 10.0 112.676 -171.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.03 -38.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 121.625 -0.672 . . . . 10.0 111.581 172.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.422 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 4.7 mp0 -57.16 -44.67 83.68 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.1 1.148 . . . . 10.0 114.1 173.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -63.84 -33.47 75.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 117.86 0.3 . . . . 10.0 110.639 173.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.03 -41.68 31.64 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.302 1.429 . . . . 10.0 111.178 -172.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 4' ' ' GLU . 30.7 pttt -69.21 -36.17 76.97 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 118.297 1.049 . . . . 10.0 111.96 174.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.81 -55.91 28.35 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.637 0.775 . . . . 10.0 111.351 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -64.56 -33.24 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.576 0.626 . . . . 10.0 112.564 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -57.65 -52.5 65.17 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 119.126 0.876 . . . . 10.0 110.459 169.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -62.21 -13.3 9.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -97.29 -36.16 10.49 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.494 1.518 . . . . 10.0 112.785 -175.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -137.01 3.63 2.68 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 116.373 1.99 . . . . 10.0 116.373 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -122.77 -43.02 2.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.208 1.403 . . . . 10.0 111.839 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.5 4.9 2.06 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.667 1.358 . . . . 10.0 114.667 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -38.46 14.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.511 1.524 . . . . 10.0 111.932 172.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 m -88.61 -38.04 15.15 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.487 2.315 . . . . 10.0 113.751 168.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.414 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.6 m-70 -114.66 -172.59 2.14 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 129.137 2.975 . . . . 10.0 111.917 -175.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.4 m -166.41 153.1 9.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.68 1.992 . . . . 10.0 108.163 157.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.8 p -156.65 -35.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 113.562 0.949 . . . . 10.0 113.562 169.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -60.33 -4.13 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 130.675 3.59 . . . . 10.0 115.96 -168.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -151.17 7.35 0.52 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.68 2.792 . . . . 10.0 111.662 -170.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.36 0 C-N-CA 125.536 1.541 . . . . 10.0 111.943 -161.081 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 118.916 -0.564 . . . . 10.0 111.852 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.414 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -128.18 172.57 19.16 Favored Glycine 0 CA--C 1.544 1.887 0 C-N-CA 124.488 1.042 . . . . 10.0 110.964 150.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.21 166.02 22.51 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 124.392 3.395 . . . . 10.0 112.416 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.98 137.67 57.88 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.07 -1.019 . . . . 10.0 109.196 159.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.83 60.98 2.38 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.349 1.431 . . . . 10.0 111.981 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.18 87.65 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 130.263 3.425 . . . . 10.0 113.568 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.36 43.04 65.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.953 1.74 . . . . 10.0 114.663 169.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -72.4 149.6 44.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 117.849 0.825 . . . . 10.0 110.577 173.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 75.52 76.41 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.017 2.527 . . . . 10.0 111.609 -161.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.54 29.97 0.23 Allowed Glycine 0 CA--C 1.536 1.361 0 N-CA-C 117.353 1.701 . . . . 10.0 117.353 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.494 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 13.0 ptt85 -152.53 -84.17 0.08 Allowed 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 120.748 2.274 . . . . 10.0 115.787 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.494 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 16.7 pttp -168.28 -176.38 2.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.697 2.799 . . . . 10.0 109.943 -177.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -67.15 -132.72 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.718 2.007 . . . . 10.0 111.873 162.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -18.17 115.96 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 1 C-N-CA 130.708 4.004 . . . . 10.0 117.809 -178.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -152.23 3.52 0.37 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 117.971 2.582 . . . . 10.0 117.971 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 155.0 88.64 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 121.299 1.863 . . . . 10.0 111.874 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.29 74.04 3.16 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.243 2.628 . . . . 10.0 109.637 170.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.48 -73.22 1.63 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.03 1.3 . . . . 10.0 111.624 -170.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 t80 43.6 -143.73 0.12 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.632 1.173 . . . . 10.0 110.102 -164.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.8 m -164.5 108.76 0.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.809 2.044 . . . . 10.0 108.096 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -152.8 176.53 11.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.151 1.38 . . . . 10.0 112.211 -172.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.4 p -80.35 109.78 15.17 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.021 0.915 . . . . 10.0 111.99 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -55.05 -22.41 15.79 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.743 0.817 . . . . 10.0 112.821 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -48.72 -43.04 36.98 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.495 1.118 . . . . 10.0 113.445 170.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.423 ' ND2' ' HZ3' ' A' ' 53' ' ' LYS . 49.9 t-20 -76.58 -38.81 54.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.751 1.221 . . . . 10.0 112.673 172.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.423 ' HZ3' ' ND2' ' A' ' 52' ' ' ASN . 6.8 mmpt? -74.93 -52.11 12.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.819 0.847 . . . . 10.0 110.827 -172.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.97 -21.04 66.39 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.62 1.568 . . . . 10.0 113.466 173.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -28.84 62.85 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.426 1.012 . . . . 10.0 112.815 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.04 4.46 72.48 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 123.878 0.751 . . . . 10.0 114.907 168.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 pp -61.26 178.23 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 10.0 111.313 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.0 m -148.77 108.81 4.08 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 123.256 1.503 . . . . 10.0 111.195 -163.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -54.48 116.37 2.62 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.708 2.003 . . . . 10.0 109.24 169.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 -44.98 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.187 1.395 . . . . 10.0 113.07 -168.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -170.03 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.683 1.993 . . . . 10.0 107.32 162.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -47.34 -54.85 10.04 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.353 2.661 . . . . 10.0 112.399 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -52.72 60.83 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 128.371 2.668 . . . . 10.0 111.962 -176.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.06 -28.34 61.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.919 0.888 . . . . 10.0 112.302 -177.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.87 -55.08 33.47 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.562 0.745 . . . . 10.0 109.957 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.54 -43.79 98.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.458 1.103 . . . . 10.0 110.433 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.8 t80 -66.41 -46.58 76.09 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.038 0.935 . . . . 10.0 112.053 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 -37.25 83.23 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.77 1.623 . . . . 10.0 112.698 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.64 -36.76 84.89 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.036 -0.983 . . . . 10.0 113.063 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -163.45 106.19 0.97 Allowed Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 119.685 1.129 . . . . 10.0 111.873 160.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.43 -48.76 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.481 2.121 . . . . 10.0 110.685 -171.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -37.9 77.2 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.177 1.391 . . . . 10.0 112.475 179.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -61.6 -54.54 41.57 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.69 1.196 . . . . 10.0 110.63 168.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -64.43 -45.25 88.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.918 1.081 . . . . 10.0 113.918 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 pt -136.0 95.45 13.62 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 123.992 0.917 . . . . 10.0 110.548 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.01 76.69 2.05 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 125.035 3.824 . . . . 10.0 113.84 -163.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.51 -25.5 0.03 OUTLIER Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.222 1.868 . . . . 10.0 112.061 165.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.3 t -40.02 116.91 0.7 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.864 2.066 . . . . 10.0 113.975 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -83.18 16.0 2.62 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.148 0.795 . . . . 10.0 113.148 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.8 ttt -67.16 79.1 0.14 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.845 1.307 . . . . 10.0 111.344 171.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tp -72.99 87.07 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 125.307 1.443 . . . . 10.0 111.714 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -161.49 -51.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.01 -0.995 . . . . 10.0 113.547 175.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.02 92.96 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.137 2.175 . . . . 10.0 115.871 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.22 -178.86 36.05 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.638 1.113 . . . . 10.0 111.436 -169.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.5 tt -155.55 82.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.201 1.0 . . . . 10.0 110.35 178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 59.78 -54.18 0.07 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 128.065 2.546 . . . . 10.0 116.157 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.24 166.53 25.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.021 2.529 . . . . 10.0 110.417 -174.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -53.95 -46.23 71.51 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.189 0.995 . . . . 10.0 113.083 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.1 m -68.34 -34.32 75.88 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.669 -0.644 . . . . 10.0 111.896 -175.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -76.86 -10.5 59.41 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.372 1.069 . . . . 10.0 113.445 171.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -35.22 35.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.098 -1.626 . . . . 10.0 114.436 155.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -62.33 -57.14 12.45 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.153 -0.967 . . . . 10.0 111.333 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 58.5 p30 -54.92 -40.65 70.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.725 1.21 . . . . 10.0 112.804 -175.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 14.9 tp -60.94 -53.88 51.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.912 2.485 . . . . 10.0 112.996 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.02 -44.92 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.185 0.994 . . . . 10.0 108.872 174.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.02 -49.97 75.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.661 0.385 . . . . 10.0 111.369 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.8 -61.75 2.1 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.267 1.427 . . . . 10.0 112.068 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.2 mt -59.65 -38.12 80.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.66 1.118 . . . . 10.0 111.815 -176.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -64.76 -24.45 67.56 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.277 1.031 . . . . 10.0 113.596 176.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 100' ' ' LYS . 8.5 mmpt? -87.37 -40.33 14.52 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.847 -1.073 . . . . 10.0 112.239 166.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.68 -22.76 65.6 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.379 1.251 . . . . 10.0 114.379 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t -85.73 9.35 16.67 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 169.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -151.58 21.09 0.72 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.454 2.302 . . . . 10.0 111.88 -166.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.817 1.647 . . . . 10.0 111.217 -174.904 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -81.99 -177.81 6.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.282 0.633 . . . . 10.0 109.493 160.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.03 -34.14 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 120.672 -1.268 . . . . 10.0 111.041 145.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -71.55 -38.75 70.96 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 127.937 2.495 . . . . 10.0 113.557 -157.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.6 -31.33 72.47 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.19 -54.04 9.65 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 127.254 2.359 . . . . 10.0 110.29 -173.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -44.91 85.4 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.098 0.777 . . . . 10.0 113.098 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -26.97 60.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.93 1.455 . . . . 10.0 114.93 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -81.39 -32.49 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.669 1.577 . . . . 10.0 111.67 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.41 -51.33 69.87 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 121.677 -0.639 . . . . 10.0 110.219 170.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.99 -12.01 8.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -83.54 -61.3 1.87 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.232 1.013 . . . . 10.0 110.855 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -102.64 -38.25 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.599 1.16 . . . . 10.0 112.457 -170.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.7 m -83.08 -55.17 4.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.128 1.371 . . . . 10.0 111.902 -172.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.61 -15.74 42.03 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -172.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -59.6 -54.52 45.47 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 129.378 3.071 . . . . 10.0 111.898 167.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.8 m -87.5 -21.22 25.61 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.117 1.525 . . . . 10.0 115.117 169.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -134.7 57.64 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.966 1.706 . . . . 10.0 111.991 -167.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.83 120.29 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.72 -1.238 . . . . 10.0 110.827 -174.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.48 -58.39 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 127.068 2.147 . . . . 10.0 108.792 -177.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 -62.31 9.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.187 2.995 . . . . 10.0 114.376 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -151.86 17.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.16 1.784 . . . . 10.0 112.75 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.287 0 C-N-CA 125.847 1.689 . . . . 10.0 111.444 -175.702 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 114.144 1.165 . . . . 10.0 114.144 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.5 166.81 12.44 Favored Glycine 0 CA--C 1.543 1.826 0 CA-C-N 120.191 1.36 . . . . 10.0 113.7 169.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 68.4 Cg_endo -74.79 173.58 14.18 Favored 'Trans proline' 0 CA--C 1.541 0.836 1 C-N-CA 125.326 4.017 . . . . 10.0 111.097 167.224 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.582 HD22 ' CD2' ' A' ' 33' ' ' HIS . 5.9 p30 -77.58 -172.48 2.58 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.222 -0.924 . . . . 10.0 108.745 158.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.1 mt -139.37 51.98 1.75 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 122.798 1.285 . . . . 10.0 111.866 -175.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.582 ' CD2' HD22 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -54.22 134.78 44.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.866 2.866 . . . . 10.0 113.165 162.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 54.0 8.38 1.01 Allowed Glycine 0 CA--C 1.54 1.616 0 N-CA-C 118.883 2.313 . . . . 10.0 118.883 160.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -51.55 167.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.784 1.634 . . . . 10.0 111.027 170.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 61.99 36.31 15.64 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.765 1.226 . . . . 10.0 112.554 -169.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 168.4 -42.82 0.23 Allowed Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.565 1.555 . . . . 10.0 110.894 -175.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 41.6 mtp85 -80.81 159.65 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 122.442 1.115 . . . . 10.0 112.067 167.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -70.71 173.91 6.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.682 1.993 . . . . 10.0 110.998 168.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -67.74 168.76 10.77 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.327 1.851 . . . . 10.0 111.334 157.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.08 14.69 51.01 Favored Glycine 0 N--CA 1.471 0.998 0 N-CA-C 117.657 1.823 . . . . 10.0 117.657 160.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.402 ' CD ' ' H ' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -91.86 -40.52 11.14 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.952 2.101 . . . . 10.0 115.269 -158.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.63 111.17 2.81 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.13 1.372 . . . . 10.0 114.228 -164.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 131.01 18.79 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.417 2.078 . . . . 10.0 112.129 -174.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.01 1.8 69.49 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.91 0.724 . . . . 10.0 114.91 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.409 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 16.5 t80 -73.2 179.27 3.96 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 118.433 1.117 . . . . 10.0 111.052 167.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 98.7 m -154.18 89.02 1.26 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 119.517 -1.99 . . . . 10.0 109.631 176.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.35 173.61 10.8 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 128.508 2.723 . . . . 10.0 112.277 172.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.8 p -71.21 143.87 50.31 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.423 -0.798 . . . . 10.0 110.508 163.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -76.23 65.14 2.13 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.648 -1.283 . . . . 10.0 111.154 166.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.96 -59.35 0.6 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.203 1.001 . . . . 10.0 110.474 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.438 ' CG ' ' H ' ' A' ' 53' ' ' LYS . 6.0 p30 -54.88 -70.1 0.11 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.919 1.687 . . . . 10.0 111.231 174.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -63.68 -13.13 40.07 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 130.566 3.547 . . . . 10.0 115.309 171.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.29 -56.27 7.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.178 -0.951 . . . . 10.0 111.485 160.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -56.3 -27.95 57.2 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.385 1.874 . . . . 10.0 115.448 -170.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.97 7.09 61.54 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.967 1.147 . . . . 10.0 115.967 168.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -56.93 5.96 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 129.463 3.105 . . . . 10.0 117.155 -171.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.6 m 50.59 87.8 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.39 2.676 . . . . 10.0 113.627 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -54.45 125.17 18.48 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.601 2.361 . . . . 10.0 114.987 -171.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -164.66 179.17 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.386 2.674 . . . . 10.0 109.343 -173.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -58.01 -39.3 77.96 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.173 -0.954 . . . . 10.0 112.784 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.89 10.28 0.22 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.444 1.898 . . . . 10.0 115.251 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.2 p -158.21 -33.13 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.757 1.223 . . . . 10.0 111.464 -166.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.13 -29.35 63.98 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 120.469 1.486 . . . . 10.0 112.508 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 73.9 mtm -71.52 -40.1 70.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.251 0.932 . . . . 10.0 111.844 175.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -50.48 72.02 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 167.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.5 -44.73 86.12 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 113.361 0.874 . . . . 10.0 113.361 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -73.38 -22.59 60.23 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 121.047 1.749 . . . . 10.0 113.715 176.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -85.75 -23.85 27.13 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.26 1.208 . . . . 10.0 114.26 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.64 65.56 1.97 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.942 1.297 . . . . 10.0 111.445 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -62.05 -51.55 3.61 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.993 2.462 . . . . 10.0 113.267 -164.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -70.72 -20.8 62.62 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.165 1.786 . . . . 10.0 112.734 -173.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -76.28 -54.39 6.85 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.376 1.47 . . . . 10.0 111.148 163.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -56.87 -45.8 82.24 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.191 0.597 . . . . 10.0 112.335 -175.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.2 pt -133.44 111.91 12.83 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.632 1.173 . . . . 10.0 109.663 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.91 161.11 40.91 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.789 1.66 . . . . 10.0 110.306 175.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.36 5.8 82.58 Favored Glycine 0 CA--C 1.536 1.373 0 CA-C-O 118.648 -1.085 . . . . 10.0 114.769 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m -93.79 122.22 36.04 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.526 1.663 . . . . 10.0 110.769 165.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.26 -10.19 55.05 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.598 1.332 . . . . 10.0 114.598 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttt -21.65 97.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.855 2.862 . . . . 10.0 114.853 -172.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.09 69.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 125.652 1.581 . . . . 10.0 109.93 -172.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -164.23 -37.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.069 1.747 . . . . 10.0 111.662 170.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.31 -8.7 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 120.8 3.63 . . . . 10.0 120.8 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.09 118.94 0.75 Allowed Glycine 0 CA--C 1.53 1.003 0 CA-C-N 121.185 1.812 . . . . 10.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.0 tt -66.78 -1.71 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 115.332 1.604 . . . . 10.0 115.332 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.0 tttt 70.34 178.01 0.26 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.09 1.756 . . . . 10.0 111.302 -177.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.418 ' HE2' ' OE2' ' A' ' 90' ' ' GLU . 17.8 mtmm 34.26 -105.3 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 127.435 2.294 . . . . 10.0 112.931 -172.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -178.86 -42.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 CA-C-N 120.449 1.477 . . . . 10.0 114.036 171.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.1 m -54.06 -34.63 60.58 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.604 1.162 . . . . 10.0 111.785 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.418 ' OE2' ' HE2' ' A' ' 87' ' ' LYS . 50.2 mp0 -51.75 -41.5 61.64 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.205 2.202 . . . . 10.0 111.891 172.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -49.0 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.357 1.463 . . . . 10.0 110.829 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -68.39 -32.97 73.41 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.533 1.06 . . . . 10.0 112.503 175.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -44.67 96.7 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.37 -0.832 . . . . 10.0 111.439 169.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp -58.53 -35.79 72.85 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.023 1.119 . . . . 10.0 114.023 171.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.51 -53.14 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.88 0.764 . . . . 10.0 109.17 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -49.42 77.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.871 0.468 . . . . 10.0 111.72 178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.22 -50.88 68.28 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.148 1.379 . . . . 10.0 112.662 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.78 -32.56 65.69 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.861 1.664 . . . . 10.0 112.31 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.07 -38.83 80.36 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.132 0.878 . . . . 10.0 111.618 170.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -65.41 -70.91 0.21 Allowed 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 117.282 -1.342 . . . . 10.0 111.635 163.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.41 -17.57 13.54 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 116.146 1.906 . . . . 10.0 116.146 -166.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 28.4 p -76.23 -0.45 22.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.437 1.495 . . . . 10.0 114.131 167.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.52 -19.89 0.17 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.925 2.49 . . . . 10.0 114.944 -178.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.227 2.611 . . . . 10.0 110.901 -171.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.77 0 CA-C-O 119.03 -0.872 . . . . 10.0 111.696 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -129.98 147.33 51.72 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.524 0.935 . . . . 10.0 113.524 -150.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.1 -53.77 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.324 1.45 . . . . 10.0 111.615 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.02 -50.2 74.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.893 1.677 . . . . 10.0 113.496 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.96 -37.08 42.3 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 124.099 0.96 . . . . 10.0 112.082 167.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.28 -52.93 8.1 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.619 -1.392 . . . . 10.0 109.619 -174.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -58.09 -47.12 84.18 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 118.974 1.387 . . . . 10.0 112.31 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -27.0 65.26 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 tp -90.65 -28.82 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.58 1.082 . . . . 10.0 112.551 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.48 -53.02 62.41 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.597 0.759 . . . . 10.0 109.771 166.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.43 -10.63 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -84.99 -57.68 3.0 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.723 1.209 . . . . 10.0 110.895 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -130.41 13.22 5.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.268 1.581 . . . . 10.0 115.268 -168.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.1 m -120.57 -45.29 2.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.906 1.283 . . . . 10.0 111.548 170.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.42 -28.79 70.04 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 114.201 1.186 . . . . 10.0 114.201 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -4.25 3.22 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.709 1.604 . . . . 10.0 114.282 171.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -143.56 6.69 1.46 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.168 2.187 . . . . 10.0 112.69 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -158.47 102.28 1.72 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.746 1.619 . . . . 10.0 108.903 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 p -52.6 -47.83 66.67 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.087 1.884 . . . . 10.0 116.087 -169.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 t 34.12 -82.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 130.134 3.374 . . . . 10.0 115.857 170.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.27 2.22 0.89 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.081 2.152 . . . . 10.0 113.272 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -151.16 134.31 15.99 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 128.839 2.856 . . . . 10.0 107.87 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.063 0 C-N-CA 123.993 0.806 . . . . 10.0 113.574 -172.642 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 117.203 2.298 . . . . 10.0 117.203 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.68 148.76 20.03 Favored Glycine 0 CA--C 1.538 1.496 0 CA-C-N 120.97 1.713 . . . . 10.0 111.787 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -78.34 61.71 7.92 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.019 3.146 . . . . 10.0 114.801 -160.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 49.11 0.81 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 120.536 3.532 . . . . 10.0 120.536 165.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mm? 42.56 60.41 2.4 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.592 1.957 . . . . 10.0 110.798 -171.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.79 168.51 0.28 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.92 -1.036 . . . . 10.0 109.678 157.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -23.27 110.57 0.01 OUTLIER Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.645 1.593 . . . . 10.0 113.519 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.95 -74.59 0.61 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.799 1.24 . . . . 10.0 110.036 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -64.88 84.99 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.506 1.922 . . . . 10.0 111.34 -171.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.71 -4.42 2.45 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.756 1.645 . . . . 10.0 114.696 -172.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -152.74 -172.23 4.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.365 1.466 . . . . 10.0 111.2 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -85.62 -173.71 4.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -175.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -60.78 -151.84 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.004 1.722 . . . . 10.0 111.992 158.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 95.07 -67.33 1.23 Allowed Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.662 -1.899 . . . . 10.0 116.314 167.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -69.25 25.33 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 118.954 2.946 . . . . 10.0 118.954 -152.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.24 113.59 8.41 Favored Pre-proline 0 CA--C 1.554 1.109 0 CA-C-N 121.562 1.983 . . . . 10.0 112.755 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.56 70.78 6.73 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.34 2.693 . . . . 10.0 112.832 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.86 69.76 1.16 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.556 1.074 . . . . 10.0 112.874 172.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -151.74 176.65 11.19 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.064 1.746 . . . . 10.0 109.04 174.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -152.19 115.6 4.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.908 2.083 . . . . 10.0 107.885 -165.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -61.23 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.195 1.398 . . . . 10.0 111.103 -161.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.7 t -162.57 165.73 25.6 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 128.802 2.841 . . . . 10.0 108.874 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.08 -67.5 0.6 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.597 1.159 . . . . 10.0 110.741 157.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.21 -65.07 0.21 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 129.111 2.965 . . . . 10.0 115.333 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -51.87 -70.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.07 0.85 . . . . 10.0 111.57 -176.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -74.46 -16.6 60.85 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.853 -165.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.85 -57.66 7.4 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.852 1.261 . . . . 10.0 113.775 157.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -14.93 48.02 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 115.673 1.731 . . . . 10.0 115.673 -163.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.55 11.06 85.66 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 117.915 1.926 . . . . 10.0 117.915 151.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.72 156.16 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 119.819 1.81 . . . . 10.0 113.458 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 m -68.02 108.87 3.24 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.46 1.504 . . . . 10.0 110.716 176.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.76 112.38 13.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.82 -0.55 . . . . 10.0 111.555 172.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -162.17 -162.57 0.84 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.03 1.332 . . . . 10.0 109.695 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.84 -66.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 131.091 3.756 . . . . 10.0 113.21 -174.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -58.36 -54.62 44.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.247 1.419 . . . . 10.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 78.7 p -67.84 -35.9 79.39 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.039 0.936 . . . . 10.0 112.973 -173.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.18 -27.51 59.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 119.832 1.196 . . . . 10.0 113.504 173.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 69.6 mtm -65.91 -52.13 52.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 119.446 1.021 . . . . 10.0 109.406 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.9 -44.38 91.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.136 0.493 . . . . 10.0 110.477 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -63.89 -55.72 20.63 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.22 -10.78 59.78 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 121.066 1.757 . . . . 10.0 113.348 -177.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -85.37 -25.42 27.08 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.798 1.181 . . . . 10.0 113.978 167.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -162.33 98.37 1.14 Allowed Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.618 1.099 . . . . 10.0 112.974 157.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.35 -47.68 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.765 1.643 . . . . 10.0 112.042 -167.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -64.89 -32.01 73.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.456 1.502 . . . . 10.0 113.027 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -75.78 -39.13 57.53 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-O 118.108 -0.949 . . . . 10.0 112.728 168.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -68.8 -40.18 79.72 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.517 0.932 . . . . 10.0 113.517 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.02 135.25 25.53 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.803 0.841 . . . . 10.0 110.998 174.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -80.18 50.54 3.57 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.088 3.192 . . . . 10.0 114.544 -157.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.48 61.77 0.01 OUTLIER Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.422 -0.799 . . . . 10.0 114.637 172.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -80.1 -30.16 39.13 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.463 1.283 . . . . 10.0 114.463 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 -22.28 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 117.001 2.223 . . . . 10.0 117.001 -166.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.9 ttt -34.76 100.52 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 129.071 2.948 . . . . 10.0 113.803 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 28.5 mt -76.41 71.74 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 125.879 1.672 . . . . 10.0 109.644 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -163.51 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.254 1.022 . . . . 10.0 113.236 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.78 -15.13 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 120.26 3.43 . . . . 10.0 120.26 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.67 158.52 28.69 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-N 121.695 2.043 . . . . 10.0 113.498 172.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.3 tt -78.96 -79.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.111 1.523 . . . . 10.0 115.111 -169.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -156.9 -52.76 0.08 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.024 1.73 . . . . 10.0 111.635 -169.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -162.99 161.41 25.53 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 129.627 3.171 . . . . 10.0 107.306 174.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -57.26 -46.66 82.84 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.998 0.74 . . . . 10.0 112.998 -168.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . 0.266 83.5 m -64.56 -26.61 68.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.368 1.248 . . . . 10.0 114.368 -176.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.77 -33.84 76.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.357 1.435 . . . . 10.0 111.621 169.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -45.11 77.54 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.73 1.612 . . . . 10.0 110.121 170.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -63.58 -35.56 80.91 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.99 1.316 . . . . 10.0 112.363 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -63.73 -48.97 74.9 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.822 1.649 . . . . 10.0 111.243 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.42 -35.41 62.88 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.8 mm -59.37 -57.19 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 172.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.34 95.91 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.81 0.444 . . . . 10.0 111.946 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -53.53 -63.23 1.21 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.7 1.2 . . . . 10.0 111.522 170.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.24 -27.93 69.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.605 1.093 . . . . 10.0 113.426 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -59.54 -16.76 27.03 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.693 1.133 . . . . 10.0 113.511 170.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.41 33.57 3.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.801 2.04 . . . . 10.0 113.235 165.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.23 24.58 2.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.586 1.155 . . . . 10.0 111.398 171.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -127.68 2.25 6.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.573 1.549 . . . . 10.0 113.242 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -159.64 -59.0 0.06 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.344 1.857 . . . . 10.0 109.649 -154.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 C--O 1.256 1.426 0 CA-C-O 117.004 -1.474 . . . . 10.0 109.446 134.09 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.029 0 CA-C-O 117.478 -1.734 . . . . 10.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -131.01 168.15 17.85 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 -166.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.58 -65.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.23 2.612 . . . . 10.0 110.596 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.0 -37.59 74.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.404 1.482 . . . . 10.0 113.243 174.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.461 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 5.7 mmpt? -64.84 -16.4 63.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.659 -0.686 . . . . 10.0 112.315 171.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.06 -50.58 1.23 Allowed Glycine 0 N--CA 1.468 0.81 0 C-N-CA 125.974 1.749 . . . . 10.0 112.793 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -60.03 -29.62 68.62 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.629 1.215 . . . . 10.0 113.651 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HE2' ' HE2' ' A' ' 5' ' ' LYS . 15.8 pttp -64.22 -32.18 73.66 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.995 0.918 . . . . 10.0 112.532 174.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.82 -47.93 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.603 0.761 . . . . 10.0 109.244 168.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -57.54 -53.56 56.82 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.958 0.345 . . . . 10.0 111.46 -174.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -63.27 -15.42 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 112.706 0.632 . . . . 10.0 112.706 -175.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -95.88 -63.74 1.12 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.051 2.141 . . . . 10.0 111.055 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -87.67 -17.9 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 -171.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -116.22 -52.63 2.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.148 0.979 . . . . 10.0 111.117 -169.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.57 3.71 7.27 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.564 0.95 . . . . 10.0 113.564 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.19 -67.22 0.27 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.439 1.896 . . . . 10.0 108.777 153.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.9 m -82.2 -35.36 28.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.137 1.375 . . . . 10.0 113.906 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.78 -163.0 0.96 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.861 2.465 . . . . 10.0 112.38 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 21' ' ' GLU . 8.3 t -138.15 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.477 1.111 . . . . 10.0 113.215 169.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 40.97 -25.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.346 1 C-N-CA 132.86 4.464 . . . . 10.0 118.295 -161.994 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' ' 19' ' ' THR . 86.0 tt0 -140.55 -61.33 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.275 2.23 . . . . 10.0 109.742 -169.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -78.32 88.52 4.35 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.035 0.754 . . . . 10.0 113.035 177.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.42 0 N-CA-C 118.627 2.211 . . . . 10.0 118.627 150.409 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 119.425 -0.321 . . . . 10.0 111.716 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.56 163.22 28.99 Favored Glycine 0 CA--C 1.544 1.859 0 C-N-CA 124.984 1.278 . . . . 10.0 111.662 164.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.36 175.22 2.81 Favored 'Trans proline' 0 C--N 1.353 0.794 1 C-N-CA 125.653 4.236 . . . . 10.0 113.901 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -86.9 0.39 55.09 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.598 1.333 . . . . 10.0 114.598 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 mp 58.27 -31.63 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.105 3.362 . . . . 10.0 115.714 -174.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.09 68.13 0.16 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.549 3.14 . . . . 10.0 113.251 176.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.45 -51.74 2.21 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 126.75 2.119 . . . . 10.0 113.867 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 tp 66.86 -58.12 0.4 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.222 2.609 . . . . 10.0 115.252 173.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.16 115.77 6.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.392 1.077 . . . . 10.0 109.588 -170.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 -8.04 71.59 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 127.076 2.274 . . . . 10.0 114.217 -174.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -87.79 -83.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.082 1.353 . . . . 10.0 114.469 -168.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.65 175.42 1.09 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.341 2.656 . . . . 10.0 111.991 161.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.1 t -82.24 166.31 19.68 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.997 2.119 . . . . 10.0 111.371 163.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.12 -14.64 2.16 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 126.116 1.817 . . . . 10.0 116.789 159.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.72 -5.48 5.88 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 129.042 2.937 . . . . 10.0 115.333 -173.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -46.78 128.54 8.56 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 126.009 1.724 . . . . 10.0 111.851 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.62 106.4 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 123.233 2.622 . . . . 10.0 111.153 -172.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.53 -44.38 1.43 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.21 1.386 . . . . 10.0 113.724 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.43 134.48 56.49 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 122.467 1.127 . . . . 10.0 110.287 -173.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.4 m -150.73 86.36 1.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 123.607 1.67 . . . . 10.0 106.823 -156.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.48 142.8 30.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 131.621 3.968 . . . . 10.0 108.305 173.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.6 t 45.36 -138.31 0.49 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.74 0.816 . . . . 10.0 111.734 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -161.24 -65.69 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.032 1.733 . . . . 10.0 110.433 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.6 -54.69 43.01 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.085 1.354 . . . . 10.0 112.607 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -56.84 -45.86 82.09 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 119.676 1.126 . . . . 10.0 112.561 175.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mmmt -53.81 -49.94 67.24 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.386 1.074 . . . . 10.0 111.722 173.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -66.03 -38.41 88.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.842 1.257 . . . . 10.0 113.219 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -161.07 81.88 0.63 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.438 1.895 . . . . 10.0 110.726 -166.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -118.24 165.58 12.79 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.369 1.462 . . . . 10.0 111.289 164.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -68.11 169.34 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.929 1.691 . . . . 10.0 114.807 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.7 m -72.22 110.19 6.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.296 1.439 . . . . 10.0 111.06 167.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -61.66 140.83 58.12 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.425 1.09 . . . . 10.0 111.388 161.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -178.31 -33.03 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 125.731 1.612 . . . . 10.0 114.998 -169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 166.46 -61.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.696 2.798 . . . . 10.0 112.306 158.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -41.49 85.31 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.84 1.256 . . . . 10.0 112.091 -177.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -54.71 -38.86 67.58 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.596 1.159 . . . . 10.0 112.579 168.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.2 mp -75.35 -28.64 59.66 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 119.881 1.219 . . . . 10.0 113.579 172.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 38.3 mtt -61.53 -53.61 54.11 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.987 1.267 . . . . 10.0 108.589 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.14 -37.81 88.6 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.699 0.285 . . . . 10.0 110.977 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.04 -45.54 81.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.198 -0.906 . . . . 10.0 113.183 175.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -37.88 89.05 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 120.931 1.696 . . . . 10.0 111.633 176.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -70.2 -24.65 63.15 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.726 1.38 . . . . 10.0 114.726 174.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.8 75.71 2.3 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 119.855 1.207 . . . . 10.0 114.01 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -70.88 -45.71 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.973 1.782 . . . . 10.0 112.224 -168.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -68.84 21.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.82 2.848 . . . . 10.0 114.658 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -161.47 -30.75 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.843 1.657 . . . . 10.0 112.786 -167.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.774 1.028 . . . . 10.0 113.774 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.11 157.11 79.11 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 125.419 1.488 . . . . 10.0 110.257 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.11 117.92 5.26 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.604 2.203 . . . . 10.0 110.603 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 85.64 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.802 1.191 . . . . 10.0 113.612 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -127.28 150.61 49.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.053 1.341 . . . . 10.0 110.53 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -142.0 26.6 1.85 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.763 1.625 . . . . 10.0 113.118 -171.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.3 ttt -55.8 103.97 0.12 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.84 0.856 . . . . 10.0 110.554 159.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.73 79.98 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.578 1.151 . . . . 10.0 109.467 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -161.91 -63.29 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.153 0.581 . . . . 10.0 111.983 174.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.48 -2.63 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 120.495 3.517 . . . . 10.0 120.495 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -145.6 86.47 0.17 Allowed Glycine 0 CA--C 1.529 0.937 0 CA-C-N 120.9 1.682 . . . . 10.0 112.262 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.8 tt -64.24 -57.76 10.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 114.12 1.155 . . . . 10.0 114.12 -170.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm 163.4 -168.75 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 131.667 3.987 . . . . 10.0 109.095 -174.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -53.12 -61.78 2.07 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 128.335 2.654 . . . . 10.0 115.582 -167.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.5 -40.61 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.518 1.527 . . . . 10.0 114.456 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -50.82 60.31 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.397 1.479 . . . . 10.0 111.656 -173.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -53.9 -49.06 69.43 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.389 0.675 . . . . 10.0 110.994 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -33.34 75.24 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.517 1.127 . . . . 10.0 112.788 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -76.68 -33.88 58.23 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 120.394 1.452 . . . . 10.0 114.428 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -69.91 -46.5 65.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.606 1.094 . . . . 10.0 112.069 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.58 -39.99 85.91 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.75 1.22 . . . . 10.0 113.265 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mm -65.0 -44.01 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.289 1.036 . . . . 10.0 110.479 173.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.73 -41.2 97.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.299 0.64 . . . . 10.0 111.75 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -56.72 -59.01 5.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.203 1.001 . . . . 10.0 112.418 170.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.8 -27.68 66.08 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.931 1.086 . . . . 10.0 113.931 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -58.89 -28.19 65.92 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.654 1.182 . . . . 10.0 112.637 167.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.403 ' HZ2' ' CD ' ' A' ' 104' ' ' GLU . 1.9 tmtp? -81.94 -51.92 7.59 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.931 1.293 . . . . 10.0 111.549 167.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.45 -12.52 15.07 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 116.39 1.996 . . . . 10.0 116.39 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.3 t -72.3 -0.8 13.18 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.723 -1.235 . . . . 10.0 114.312 164.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -151.12 -22.32 0.21 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.94 1.696 . . . . 10.0 113.519 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.403 ' CD ' ' HZ2' ' A' ' 100' ' ' LYS . 9.5 tt0 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 127.652 2.381 . . . . 10.0 109.965 172.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.822 0 CA-C-O 119.263 -0.743 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -127.78 136.55 51.64 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.623 0.725 . . . . 10.0 112.583 -150.096 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.49 -58.86 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.141 1.777 . . . . 10.0 110.989 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -60.25 -48.58 81.11 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.031 1.333 . . . . 10.0 113.153 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -53.33 -35.01 59.73 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.497 0.719 . . . . 10.0 111.721 170.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.31 -53.55 7.56 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.934 1.254 . . . . 10.0 110.38 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 97' ' ' TYR . 1.2 ptpt -58.75 -44.73 90.62 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.346 1.573 . . . . 10.0 112.679 177.154 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -39.7 79.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 118.07 -0.967 . . . . 10.0 112.898 -178.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -73.47 -33.16 39.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.929 1.241 . . . . 10.0 111.955 174.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -56.78 -50.56 71.95 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.284 -0.885 . . . . 10.0 110.077 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.2 t -60.15 -14.29 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -94.22 -56.62 2.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.267 1.427 . . . . 10.0 111.503 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -108.11 1.66 22.45 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.15 1.537 . . . . 10.0 115.15 -172.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.0 m -123.8 -49.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.126 1.37 . . . . 10.0 112.455 -179.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.68 2.93 2.81 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.921 1.082 . . . . 10.0 113.921 178.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -59.03 6.1 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.477 -0.764 . . . . 10.0 109.359 158.215 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.4 m -87.58 -28.06 22.16 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.608 1.336 . . . . 10.0 114.608 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -108.35 -168.95 1.43 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.795 2.038 . . . . 10.0 111.558 -176.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.285 6.5 t -137.33 -75.17 0.41 Allowed 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 117.471 -1.252 . . . . 10.0 113.33 165.188 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 6.7 p 45.58 -56.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 130.394 3.478 . . . . 10.0 116.587 -170.553 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -67.93 -10.14 50.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.245 1.818 . . . . 10.0 113.309 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -152.71 148.68 27.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.391 1.877 . . . . 10.0 110.356 -171.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 C-N-CA 125.486 1.517 . . . . 10.0 112.905 -176.359 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 119.698 -0.191 . . . . 10.0 111.045 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.67 176.91 16.57 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 126.047 1.784 . . . . 10.0 111.471 166.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.89 177.13 8.07 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.952 3.101 . . . . 10.0 112.266 177.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.53 10.48 27.71 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.941 2.096 . . . . 10.0 114.743 -175.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.477 ' C ' ' HD1' ' A' ' 33' ' ' HIS . 7.4 mp 57.6 -16.59 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 128.809 2.844 . . . . 10.0 116.029 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.477 ' HD1' ' C ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER 33.94 68.99 0.15 Allowed 'General case' 0 C--O 1.24 0.591 0 C-N-CA 129.546 3.138 . . . . 10.0 115.768 156.738 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 67.02 2.37 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 125.503 1.525 . . . . 10.0 111.11 -176.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.01 171.29 2.28 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 117.993 0.896 . . . . 10.0 112.304 -176.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 76.37 130.09 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 127.642 2.377 . . . . 10.0 114.424 171.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.44 -39.82 1.5 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.004 1.764 . . . . 10.0 113.822 -179.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -169.93 0.68 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.777 1.631 . . . . 10.0 113.929 174.089 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.525 ' HZ3' ' NE2' ' A' ' 42' ' ' GLN . 31.2 mtmm -77.43 -164.43 0.48 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.793 1.637 . . . . 10.0 113.036 -174.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -107.3 -99.03 0.36 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 117.586 -1.197 . . . . 10.0 109.981 168.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 7.54 -103.94 0.01 OUTLIER Glycine 0 N--CA 1.477 1.389 0 C-N-CA 130.144 3.735 . . . . 10.0 117.743 -177.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.525 ' NE2' ' HZ3' ' A' ' 39' ' ' LYS . 11.2 mm100 46.42 -14.27 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.087 1 C-N-CA 133.179 4.592 . . . . 10.0 121.695 161.208 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 109.98 2.85 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 121.377 1.899 . . . . 10.0 114.04 -174.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.26 62.59 8.49 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 124.037 3.158 . . . . 10.0 113.593 -167.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.45 50.97 0.08 OUTLIER Glycine 0 N--CA 1.473 1.11 0 C-N-CA 124.924 1.25 . . . . 10.0 113.299 175.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -145.92 -177.86 5.81 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.197 2.199 . . . . 10.0 108.078 -176.026 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.7 m -154.49 135.53 13.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 119.715 -1.866 . . . . 10.0 109.105 176.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -138.64 173.83 11.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.09 1.356 . . . . 10.0 112.061 -166.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.8 p -69.63 160.49 31.47 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.185 1.394 . . . . 10.0 112.557 172.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -64.8 -178.19 0.4 Allowed 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 114.916 -1.038 . . . . 10.0 111.041 161.44 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.02 -72.0 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.914 2.485 . . . . 10.0 114.02 -173.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -62.36 -64.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.153 0.978 . . . . 10.0 112.273 -169.09 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -39.64 43.95 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.531 -1.355 . . . . 10.0 113.869 175.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -65.63 -60.74 2.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.881 0.764 . . . . 10.0 112.741 178.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.37 -48.56 16.98 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.646 0.778 . . . . 10.0 112.766 -176.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.11 176.3 23.03 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.123 1.344 . . . . 10.0 115.481 -177.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -168.46 2.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 127.568 2.347 . . . . 10.0 112.099 -165.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . 0.266 2.4 m 53.83 113.64 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.022 2.529 . . . . 10.0 114.979 -174.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -64.5 156.22 30.35 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.524 -1.216 . . . . 10.0 110.26 163.146 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -174.43 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.697 1.599 . . . . 10.0 112.104 -175.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 165.69 -64.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 130.484 3.514 . . . . 10.0 110.012 173.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -46.11 -56.54 5.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.357 1.863 . . . . 10.0 112.769 -179.764 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 75.7 p -61.41 -36.01 79.12 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.679 1.592 . . . . 10.0 112.163 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -32.37 60.91 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.137 0.975 . . . . 10.0 113.051 173.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.9 mtm -63.62 -47.64 80.57 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 118.091 -0.957 . . . . 10.0 109.504 173.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -66.0 -43.01 88.99 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.554 0.616 . . . . 10.0 111.14 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -63.06 -49.8 73.11 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -177.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -43.11 92.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.779 1.172 . . . . 10.0 110.58 -178.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -74.11 -20.93 60.09 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.712 1.375 . . . . 10.0 114.712 -177.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.32 72.12 2.58 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 118.912 0.778 . . . . 10.0 111.355 178.212 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -62.91 -61.49 0.14 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.846 3.031 . . . . 10.0 115.44 -165.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -68.93 -26.06 64.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.035 0.934 . . . . 10.0 111.694 -178.127 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.38 90.95 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.861 1.264 . . . . 10.0 110.909 166.585 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -76.21 -53.9 7.58 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.266 -0.896 . . . . 10.0 113.299 178.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.56 119.51 15.18 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.952 1.301 . . . . 10.0 109.37 171.167 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.35 -30.71 44.53 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.864 2.376 . . . . 10.0 113.515 -168.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -74.92 70.62 1.75 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.177 0.894 . . . . 10.0 111.625 172.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.6 m -138.84 152.41 47.82 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.997 0.919 . . . . 10.0 111.43 172.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -141.41 12.87 2.16 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.237 1.815 . . . . 10.0 113.327 -178.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.2 ttt -55.03 93.02 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.255 1.822 . . . . 10.0 111.967 165.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.9 mm -71.79 76.65 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 124.812 1.245 . . . . 10.0 110.086 176.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -162.18 -74.09 0.05 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.959 0.726 . . . . 10.0 112.959 176.33 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.73 -67.94 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.443 2.697 . . . . 10.0 116.46 -169.29 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.9 82.1 0.12 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 125.984 1.754 . . . . 10.0 112.653 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 tt -61.43 -43.83 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 123.905 0.882 . . . . 10.0 112.293 -165.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.253 10.8 mtpt 161.45 -78.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 130.938 3.695 . . . . 10.0 110.061 146.026 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -77.0 -83.59 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt 173.69 -43.76 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 128.12 2.568 . . . . 10.0 110.706 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.7 m -50.53 -40.59 52.1 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.334 1.853 . . . . 10.0 112.168 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -59.89 -39.78 86.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.446 0.698 . . . . 10.0 111.072 177.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -51.2 68.19 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.104 1.362 . . . . 10.0 109.881 -179.354 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.07 -26.68 59.54 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -66.66 -43.06 85.56 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.605 1.093 . . . . 10.0 110.916 168.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.35 -35.71 72.36 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.439 1.274 . . . . 10.0 114.439 174.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.36 -55.88 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 172.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -43.9 88.74 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.251 0.621 . . . . 10.0 111.946 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.408 ' CE1' ' HB3' ' A' ' 7' ' ' LYS . 3.0 t80 -52.84 -63.41 1.15 Allowed 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.776 1.23 . . . . 10.0 111.739 170.565 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.23 -30.1 71.17 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.719 1.145 . . . . 10.0 112.334 -174.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -57.69 -32.93 67.85 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.241 1.017 . . . . 10.0 112.497 171.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.5 mmtt -80.62 -53.37 6.6 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 125.065 1.346 . . . . 10.0 111.98 165.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.79 -24.3 34.96 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.319 1.97 . . . . 10.0 116.319 -167.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.5 t -74.14 2.11 9.7 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.126 0.971 . . . . 10.0 113.599 171.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -152.99 -18.55 0.15 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 127.941 2.496 . . . . 10.0 114.981 -179.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.064 2.146 . . . . 10.0 113.316 -171.996 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 109.266 -1.533 . . . . 10.0 109.266 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.499 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 1.8 m-20 -114.87 -113.56 0.34 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.463 1.505 . . . . 10.0 111.357 -165.397 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -161.51 -59.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 128.39 2.676 . . . . 10.0 107.499 -179.137 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.06 -48.83 75.31 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.398 1.079 . . . . 10.0 112.405 176.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -62.18 -14.89 42.28 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.965 1.098 . . . . 10.0 113.965 172.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.45 -55.8 2.52 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 125.292 1.425 . . . . 10.0 110.032 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 pttt -61.19 -37.48 83.11 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.144 0.972 . . . . 10.0 113.197 -176.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -13.95 60.91 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.216 1.191 . . . . 10.0 114.216 176.578 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.1 mm -103.22 -34.61 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.593 1.157 . . . . 10.0 111.222 169.711 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.67 -53.15 58.61 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.611 0.641 . . . . 10.0 110.793 172.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -66.61 -8.04 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.513 -0.742 . . . . 10.0 112.637 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.84 -50.04 5.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.501 1.92 . . . . 10.0 111.224 -177.078 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -122.82 -1.23 8.94 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -174.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -117.48 -46.2 2.69 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.562 1.145 . . . . 10.0 111.358 -177.355 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.08 -10.75 6.68 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.063 0.764 . . . . 10.0 113.063 168.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -19.02 40.31 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.716 1.606 . . . . 10.0 113.042 166.148 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -143.4 -26.59 0.57 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.537 1.935 . . . . 10.0 115.074 -177.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -110.18 -172.84 2.12 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 128.056 2.542 . . . . 10.0 110.727 179.102 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.7 p -131.16 -82.68 0.52 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.863 1.06 . . . . 10.0 113.863 169.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.294 9.9 p 50.96 -45.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 131.507 3.923 . . . . 10.0 116.502 -169.752 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -72.81 -4.33 30.97 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.096 1.358 . . . . 10.0 112.165 170.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -151.66 173.41 14.71 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.588 1.955 . . . . 10.0 110.031 -166.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.152 0 C-N-CA 125.206 1.384 . . . . 10.0 116.512 -163.968 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -123.12 160.43 17.63 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.828 1.204 . . . . 10.0 111.116 166.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -66.56 6.45 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.742 1 C-N-CA 126.905 5.07 . . . . 10.0 117.378 -162.416 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 61.77 159.74 0.06 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.968 2.107 . . . . 10.0 112.171 -147.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.76 78.35 9.58 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.334 -1.358 . . . . 10.0 107.334 165.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 83.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.467 1.107 . . . . 10.0 110.928 176.748 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.87 -67.66 0.07 OUTLIER Glycine 0 CA--C 1.529 0.936 0 C-N-CA 128.047 2.737 . . . . 10.0 113.158 -178.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.57 -179.84 0.16 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.503 2.721 . . . . 10.0 111.43 -169.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 67.79 82.58 0.17 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.448 1.899 . . . . 10.0 113.504 -174.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.68 -33.69 4.02 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.234 1.873 . . . . 10.0 112.602 169.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -77.62 -168.16 1.12 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.046 1.338 . . . . 10.0 111.576 165.537 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.63 158.5 44.23 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.826 1.25 . . . . 10.0 110.044 -167.87 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -62.25 158.99 15.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 115.357 1.614 . . . . 10.0 115.357 -169.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.65 7.9 38.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.436 1.735 . . . . 10.0 117.436 169.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -100.65 12.35 37.6 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -161.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.42 146.08 89.91 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.031 0.932 . . . . 10.0 113.513 -178.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.63 58.92 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.727 2.951 . . . . 10.0 113.709 178.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 106.96 0.78 36.12 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 125.459 1.504 . . . . 10.0 116.134 168.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.63 132.97 51.23 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.969 1.385 . . . . 10.0 113.266 179.071 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -71.78 84.93 0.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.977 1.711 . . . . 10.0 112.219 175.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.77 175.19 10.31 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.105 1.362 . . . . 10.0 111.478 163.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -69.94 158.61 35.28 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.249 -0.907 . . . . 10.0 110.482 171.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -75.62 -9.32 58.49 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -178.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.16 -77.95 0.21 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.001 0.92 . . . . 10.0 113.162 -170.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.598 ' ND2' ' HG1' ' A' ' 78' ' ' THR . 4.0 p-10 -68.11 -23.81 64.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.828 1.418 . . . . 10.0 114.828 -163.084 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -34.94 79.45 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.672 1.124 . . . . 10.0 113.3 169.501 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.82 -69.11 0.35 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.852 0.751 . . . . 10.0 110.693 162.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -76.92 60.81 1.84 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 10.0 112.414 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -85.09 -162.47 35.65 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.539 1.542 . . . . 10.0 114.637 -177.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.0 pt -169.06 146.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 127.79 2.436 . . . . 10.0 107.945 -166.468 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.0 m -72.59 124.4 25.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.058 1.343 . . . . 10.0 110.302 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -75.41 130.99 39.87 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 123.178 0.591 . . . . 10.0 111.277 175.651 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -164.47 161.49 21.4 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.447 2.299 . . . . 10.0 108.942 -168.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.99 46.82 0.06 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.58 1.952 . . . . 10.0 113.374 176.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -162.35 -62.14 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 129.25 3.02 . . . . 10.0 107.543 -171.171 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 44.5 p -65.99 -29.62 70.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 117.681 -1.152 . . . . 10.0 113.05 -177.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.27 -26.65 60.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.679 1.127 . . . . 10.0 112.908 169.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.2 mtt -65.54 -53.47 41.69 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.824 1.193 . . . . 10.0 108.421 172.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -67.33 -38.94 85.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.68 -0.236 . . . . 10.0 111.006 -176.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -60.72 -63.31 1.34 Allowed 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 119.044 -0.503 . . . . 10.0 111.453 173.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -32.83 74.56 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 120.155 1.343 . . . . 10.0 111.615 -169.941 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.48 -17.64 55.98 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.922 1.453 . . . . 10.0 114.922 175.501 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.09 56.26 0.81 Allowed Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.329 1.452 . . . . 10.0 112.189 -169.574 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.8 -50.92 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.661 2.241 . . . . 10.0 112.772 -159.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -64.27 -24.77 67.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.462 1.905 . . . . 10.0 112.865 -177.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -75.34 -54.13 7.58 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.948 1.299 . . . . 10.0 110.546 167.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -69.54 -30.71 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 -170.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 pt -140.43 118.13 8.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.465 1.106 . . . . 10.0 109.963 163.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.8 151.69 74.17 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.501 2.134 . . . . 10.0 111.484 -176.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.37 5.49 67.33 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 118.726 -1.041 . . . . 10.0 115.223 179.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.598 ' HG1' ' ND2' ' A' ' 52' ' ' ASN . 1.5 t -75.25 -3.56 33.93 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 116.258 1.947 . . . . 10.0 116.258 -170.302 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.2 tptp 59.28 -18.88 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 119.316 3.08 . . . . 10.0 119.316 159.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 19.3 ttt -46.32 114.6 0.83 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.904 2.481 . . . . 10.0 112.058 178.0 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.6 mp -82.43 52.72 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.715 1.206 . . . . 10.0 110.427 -176.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -164.06 150.98 11.7 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.02 1.728 . . . . 10.0 108.939 169.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.28 139.36 5.82 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.424 1.49 . . . . 10.0 108.69 177.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.19 87.88 0.49 Allowed Glycine 0 CA--C 1.529 0.911 0 CA-C-N 118.084 0.402 . . . . 10.0 112.837 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.3 tt -68.51 12.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.977 1.843 . . . . 10.0 115.977 -166.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 59.4 -0.26 0.18 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.881 2.549 . . . . 10.0 117.881 173.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -160.27 104.12 1.46 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.879 2.072 . . . . 10.0 109.199 -168.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -67.67 -13.77 62.37 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.338 1.607 . . . . 10.0 115.338 -177.319 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -62.76 -63.22 1.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.005 0.821 . . . . 10.0 109.323 163.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -50.87 -34.71 29.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.447 1.899 . . . . 10.0 112.814 176.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 91' ' ' ARG . 1.2 tpm_? -51.18 -50.08 59.69 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 174.049 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -75.52 -43.47 48.79 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.952 1.701 . . . . 10.0 110.641 175.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.499 ' CG ' ' H ' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -57.3 -50.13 73.89 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.078 1.751 . . . . 10.0 112.124 -174.226 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -65.79 -38.68 89.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.4 0.546 . . . . 10.0 112.232 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.8 mt -61.38 -48.82 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.414 0.686 . . . . 10.0 109.492 176.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.67 93.85 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.748 1.219 . . . . 10.0 112.868 176.22 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.419 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -50.16 -53.29 28.72 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.023 1.329 . . . . 10.0 111.394 169.651 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 35.8 mt -67.54 -31.58 71.78 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.381 -0.824 . . . . 10.0 112.843 178.534 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -59.61 -26.88 65.82 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.323 1.231 . . . . 10.0 114.323 167.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.494 ' HZ3' ' CD ' ' A' ' 104' ' ' GLU . 0.1 OUTLIER -72.79 -54.36 9.07 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.011 0.823 . . . . 10.0 109.998 162.535 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.19 -25.48 33.02 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.512 1.671 . . . . 10.0 115.512 -175.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.25 5.6 11.89 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.052 1.341 . . . . 10.0 114.161 172.584 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -150.21 -15.63 0.25 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.564 1.946 . . . . 10.0 113.72 -170.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.494 ' CD ' ' HZ3' ' A' ' 100' ' ' LYS . 33.5 mt-10 . . . . . 0 C--O 1.258 1.515 0 C-N-CA 126.873 2.069 . . . . 10.0 110.221 -161.488 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.286 0 CA-C-O 119.59 -0.561 . . . . 10.0 111.973 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -131.79 122.3 25.57 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.299 1.04 . . . . 10.0 111.134 -157.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -52.82 -55.95 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.012 1.725 . . . . 10.0 111.71 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.8 -44.16 90.71 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 113.646 0.98 . . . . 10.0 113.646 -178.196 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.1 -36.12 72.42 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.156 0.582 . . . . 10.0 110.195 172.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.75 -45.54 16.87 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 124.68 1.133 . . . . 10.0 110.972 -175.029 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -74.95 -29.12 60.85 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -60.86 -53.48 56.78 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.43 1.013 . . . . 10.0 111.051 168.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.9 tp -64.23 -32.28 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 118.787 0.721 . . . . 10.0 112.001 177.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.478 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.7 t80 -59.37 -56.93 15.77 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 118.912 0.778 . . . . 10.0 111.311 170.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.32 -9.06 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 O-C-N 121.633 -0.667 . . . . 10.0 112.713 -178.353 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -63.67 1.25 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.743 1.217 . . . . 10.0 110.501 173.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -113.61 -2.78 13.72 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.774 1.768 . . . . 10.0 115.774 -167.795 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.3 m -103.44 -42.96 5.54 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 124.234 1.014 . . . . 10.0 111.23 171.051 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.01 -9.57 4.54 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.233 1.198 . . . . 10.0 114.233 173.191 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.73 -16.43 63.76 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.226 1.41 . . . . 10.0 112.979 167.855 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -143.54 -33.9 0.42 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.828 1.651 . . . . 10.0 113.928 -177.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -100.76 -178.16 3.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.372 2.269 . . . . 10.0 110.621 173.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.4 t -175.74 117.25 0.15 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.38 1.072 . . . . 10.0 110.771 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.4 p -143.74 -63.64 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.217 1.407 . . . . 10.0 112.761 -173.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -66.45 -32.21 73.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 120.87 1.668 . . . . 10.0 110.507 170.153 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -68.05 120.74 14.78 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.745 1.218 . . . . 10.0 109.065 156.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.331 0 C-N-CA 123.91 0.767 . . . . 10.0 112.914 174.999 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.71 -178.94 16.51 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 126.3 1.905 . . . . 10.0 108.934 155.462 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -72.84 -176.45 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 CA-C-N 120.03 1.915 . . . . 10.0 111.251 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -64.42 -35.92 82.48 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 179.342 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp 67.53 68.48 0.37 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.832 2.853 . . . . 10.0 111.006 -150.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.88 73.71 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.47 1.908 . . . . 10.0 112.619 161.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.58 -67.48 0.41 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 127.402 2.429 . . . . 10.0 114.706 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 54.1 -163.79 0.11 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.116 2.166 . . . . 10.0 113.084 -169.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 67.86 10.14 7.59 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.105 2.562 . . . . 10.0 114.743 -176.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -160.17 13.06 0.18 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.787 1.66 . . . . 10.0 114.16 -179.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.51 169.29 24.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.826 1.25 . . . . 10.0 111.943 -177.194 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -65.04 163.28 15.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.85 1.66 . . . . 10.0 112.564 179.245 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.4 p -69.82 164.58 23.34 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.414 0.686 . . . . 10.0 110.957 170.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.46 -112.76 3.78 Favored Glycine 0 N--CA 1.47 0.938 0 CA-C-O 118.193 -1.337 . . . . 10.0 115.68 169.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 38.37 2.41 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 1 C-N-CA 132.02 4.128 . . . . 10.0 121.104 178.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -44.89 104.25 0.38 Allowed Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 127.653 2.381 . . . . 10.0 114.814 -178.612 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.91 50.73 3.57 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 123.778 2.985 . . . . 10.0 113.217 -172.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.69 49.75 0.1 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.573 1.558 . . . . 10.0 113.853 176.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -148.97 118.0 6.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.257 1.023 . . . . 10.0 110.868 176.327 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.3 m -72.34 118.04 14.74 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.857 1.663 . . . . 10.0 111.088 176.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.631 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -127.89 177.19 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.371 1.868 . . . . 10.0 112.337 -175.639 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.6 p -77.65 142.66 38.73 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.282 -0.886 . . . . 10.0 111.788 168.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -65.11 -171.96 0.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.207 2.203 . . . . 10.0 112.769 163.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 59.1 -67.13 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.445 2.698 . . . . 10.0 112.093 -166.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -47.77 -31.73 5.17 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 130.209 3.404 . . . . 10.0 113.769 -179.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.631 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 27.4 mtmm -158.7 4.3 0.1 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 129.029 2.931 . . . . 10.0 112.467 -162.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.71 -62.48 1.37 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.672 0.789 . . . . 10.0 111.098 138.026 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -19.74 58.58 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.304 1.442 . . . . 10.0 114.812 -163.785 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.28 28.05 46.13 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-O 117.471 -1.738 . . . . 10.0 116.358 161.559 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 pp -54.98 20.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 130.346 3.458 . . . . 10.0 119.801 -167.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.2 m 55.64 99.27 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 128.865 2.866 . . . . 10.0 115.033 177.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -70.47 124.46 24.25 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.606 -0.684 . . . . 10.0 111.238 167.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt -163.86 170.18 17.18 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 129.565 3.146 . . . . 10.0 107.82 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -56.13 -33.61 65.33 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -60.86 -65.28 0.72 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.454 1.102 . . . . 10.0 111.887 171.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.0 p -62.69 -39.51 94.2 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.637 1.175 . . . . 10.0 111.981 -175.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.67 -16.99 59.39 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 174.954 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 29.0 mtm -68.27 -60.42 2.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.629 1.104 . . . . 10.0 108.741 160.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.63 -43.85 72.64 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.872 0.733 . . . . 10.0 111.006 -175.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -64.8 -54.97 22.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.151 -0.928 . . . . 10.0 113.07 178.038 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -26.09 65.37 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.741 1.61 . . . . 10.0 113.644 -178.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.46 -36.45 79.01 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.933 1.242 . . . . 10.0 112.614 171.153 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -161.58 96.01 1.3 Allowed Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.721 1.146 . . . . 10.0 112.594 169.638 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.67 -44.11 0.76 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.416 2.077 . . . . 10.0 111.098 -167.237 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -71.66 -24.08 61.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.092 1.757 . . . . 10.0 114.342 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -75.99 -40.11 54.47 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.886 1.221 . . . . 10.0 112.469 162.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -68.27 -41.06 81.62 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.258 0.836 . . . . 10.0 113.258 -176.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.47 156.96 69.29 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.244 1.018 . . . . 10.0 111.967 169.29 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.02 164.95 24.56 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.158 2.572 . . . . 10.0 114.833 -172.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.52 -77.43 0.09 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 127.157 2.313 . . . . 10.0 112.082 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m 58.8 -40.65 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 130.297 3.439 . . . . 10.0 118.954 164.266 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt 55.49 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 117.85 2.537 . . . . 10.0 117.85 174.629 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -64.59 79.52 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.054 1.742 . . . . 10.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tp -70.56 79.51 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.905 1.682 . . . . 10.0 111.395 178.096 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -161.12 -60.6 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 117.873 -1.061 . . . . 10.0 113.561 -176.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.14 91.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.931 2.197 . . . . 10.0 116.931 172.069 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.58 105.53 1.94 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 124.354 0.978 . . . . 10.0 111.285 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.5 tt -62.92 -56.3 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.439 0.903 . . . . 10.0 113.439 -165.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -162.34 -66.27 0.05 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.537 1.935 . . . . 10.0 111.111 174.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.9 mtmt -161.67 169.85 20.81 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.693 2.397 . . . . 10.0 107.886 -162.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -75.38 -11.35 60.03 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 -167.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.6 m -75.6 -56.17 4.95 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.942 1.247 . . . . 10.0 109.418 169.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -53.83 -36.79 62.93 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.819 2.047 . . . . 10.0 111.329 178.378 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -53.73 -46.11 70.74 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 126.833 2.053 . . . . 10.0 114.188 171.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -73.14 -45.12 58.55 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.112 0.965 . . . . 10.0 110.587 173.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -56.77 -49.23 75.92 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.781 1.232 . . . . 10.0 111.312 -170.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.1 -50.28 73.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.602 1.161 . . . . 10.0 112.538 174.365 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.8 mm -58.09 -47.18 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.182 0.993 . . . . 10.0 109.733 177.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.21 -47.32 85.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.585 1.154 . . . . 10.0 111.864 177.736 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -56.14 -56.79 16.61 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 118.661 -0.685 . . . . 10.0 112.081 173.375 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.69 -33.37 74.78 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.237 0.926 . . . . 10.0 112.484 -174.682 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -70.97 -23.58 62.24 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.381 1.252 . . . . 10.0 114.381 174.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -73.34 -59.23 2.81 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.687 -1.149 . . . . 10.0 110.825 159.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.86 -22.61 38.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 115.671 1.73 . . . . 10.0 115.671 -169.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 t -76.63 4.21 9.91 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.342 1.457 . . . . 10.0 114.582 169.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -150.37 -32.98 0.18 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.251 2.22 . . . . 10.0 112.925 -170.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 . . . . . 0 C--O 1.251 1.135 0 C-N-CA 127.595 2.358 . . . . 10.0 110.149 -156.93 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.433 ' H1 ' ' HB3' ' A' ' 93' ' ' ASP . . . . . . . . 0 N--CA 1.47 0.963 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.988 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -156.67 170.94 21.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.941 1.371 . . . . 10.0 110.367 161.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.4 t -70.08 -67.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 126.267 1.827 . . . . 10.0 109.842 172.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -37.97 89.37 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.78 1.232 . . . . 10.0 112.509 179.74 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 mttp -73.17 4.56 4.31 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 118.094 -0.955 . . . . 10.0 113.422 168.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.63 -32.44 3.38 Favored Glycine 0 N--CA 1.472 1.036 0 CA-C-N 119.832 1.197 . . . . 10.0 114.505 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -29.72 65.4 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.791 1.796 . . . . 10.0 112.429 169.917 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.06 -15.73 63.31 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.372 1.619 . . . . 10.0 115.372 179.039 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.446 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 10.9 tp -110.46 -32.16 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.82 1.248 . . . . 10.0 111.252 170.375 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -54.61 -54.92 35.02 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 118.567 0.621 . . . . 10.0 110.088 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.32 -9.84 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.898 0.879 . . . . 10.0 112.673 -178.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -99.45 -35.81 9.78 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.26 1.824 . . . . 10.0 112.869 -173.348 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.42 -57.73 2.04 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.3 1.04 . . . . 10.0 111.709 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -56.52 -48.91 76.21 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.343 1.057 . . . . 10.0 112.24 -176.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.84 3.2 3.43 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.924 1.453 . . . . 10.0 114.924 174.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.37 -11.69 61.08 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 120.169 1.35 . . . . 10.0 111.854 162.089 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.18 -47.13 0.35 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.402 1.481 . . . . 10.0 112.33 -174.538 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -88.77 -170.71 3.03 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 127.194 2.197 . . . . 10.0 111.751 176.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.454 HG21 ' H ' ' A' ' 20' ' ' VAL . 5.1 t -131.52 -76.49 0.52 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.774 1.23 . . . . 10.0 113.666 -178.388 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.454 ' H ' HG21 ' A' ' 19' ' ' THR . 31.0 t 59.06 -60.46 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 129.925 3.29 . . . . 10.0 113.87 -174.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -128.35 -23.99 3.16 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 128.421 2.688 . . . . 10.0 110.52 -173.019 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -77.36 72.41 3.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.149 1.38 . . . . 10.0 110.681 168.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.27 0 C-N-CA 127.597 2.522 . . . . 10.0 115.613 169.797 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.1 m . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 115.74 1.755 . . . . 10.0 115.74 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.02 172.48 17.13 Favored Glycine 0 CA--C 1.544 1.889 0 C-N-CA 127.336 2.398 . . . . 10.0 111.885 160.549 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -75.87 -128.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.692 4.262 . . . . 10.0 110.725 175.596 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -144.76 -173.36 4.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.341 1.857 . . . . 10.0 109.784 -178.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.14 65.18 1.4 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 122.445 1.116 . . . . 10.0 109.497 175.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.31 77.06 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.16 2.584 . . . . 10.0 112.483 164.525 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.49 -58.31 0.3 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 128.976 3.179 . . . . 10.0 112.505 -172.387 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.263 0.1 OUTLIER 48.19 -106.54 0.17 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.658 2.383 . . . . 10.0 111.378 -165.516 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.327 9.6 m-85 33.86 39.7 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.171 2.988 . . . . 10.0 117.258 171.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 131.81 -16.08 5.08 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 126.82 2.153 . . . . 10.0 115.801 -175.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -64.23 -88.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.448 2.124 . . . . 10.0 113.967 -176.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.01 168.53 3.46 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 128.365 2.666 . . . . 10.0 111.641 163.159 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.7 p -67.53 163.26 21.52 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.448 2.299 . . . . 10.0 113.994 -177.755 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.75 9.37 81.21 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 117.979 1.952 . . . . 10.0 117.979 145.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -96.53 139.27 32.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.723 1.762 . . . . 10.0 113.199 -174.387 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.8 152.13 11.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.862 2.065 . . . . 10.0 108.741 160.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.24 67.97 8.43 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.987 2.458 . . . . 10.0 111.325 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.76 4.26 51.99 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 116.338 1.295 . . . . 10.0 116.338 169.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -70.1 175.04 4.79 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 119.173 1.486 . . . . 10.0 111.466 166.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -152.71 137.48 17.03 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.849 -1.157 . . . . 10.0 112.101 -174.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -156.66 169.42 24.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.591 2.356 . . . . 10.0 111.032 -153.715 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.8 p -64.86 122.95 18.14 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.026 0.83 . . . . 10.0 112.333 -172.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -35.55 71.28 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.716 1.376 . . . . 10.0 114.716 -159.495 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.73 -27.89 68.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -179.107 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -58.31 -62.66 1.67 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.082 0.953 . . . . 10.0 111.339 -175.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.79 -54.88 7.3 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.869 1.667 . . . . 10.0 110.189 177.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -65.96 -30.62 71.22 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.327 1.851 . . . . 10.0 114.51 -177.022 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -22.4 66.26 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 117.237 -1.363 . . . . 10.0 113.493 -179.135 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.04 -10.95 2.17 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 118.011 1.964 . . . . 10.0 118.011 154.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -15.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 128.521 2.728 . . . . 10.0 115.653 -178.28 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.9 m 58.39 128.48 0.01 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 131.201 3.8 . . . . 10.0 113.932 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -69.34 123.15 20.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.182 -0.917 . . . . 10.0 111.058 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.96 176.53 9.31 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 127.247 2.219 . . . . 10.0 109.466 -177.313 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -47.24 -26.87 1.31 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.79 2.836 . . . . 10.0 114.771 178.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -74.26 -71.27 0.34 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 10.0 112.519 167.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 56.8 p -75.37 -36.03 61.02 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 128.544 2.737 . . . . 10.0 112.074 -158.478 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.68 -21.28 59.49 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.571 1.148 . . . . 10.0 111.504 175.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.5 ttm -64.47 -53.95 40.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.153 0.581 . . . . 10.0 109.51 168.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -63.22 -46.89 84.89 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.595 0.559 . . . . 10.0 110.681 178.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.9 -48.04 72.79 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 113.331 0.863 . . . . 10.0 113.331 -174.314 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -17.93 59.79 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.638 1.563 . . . . 10.0 114.122 175.331 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -72.46 -33.3 66.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.989 1.722 . . . . 10.0 113.696 164.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.74 110.5 0.95 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 120.164 1.347 . . . . 10.0 113.713 158.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.19 -44.01 0.48 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.753 1.635 . . . . 10.0 112.174 -167.607 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.1 mtmp? -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.74 2.416 . . . . 10.0 113.259 178.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -70.55 -54.6 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.294 1.438 . . . . 10.0 109.368 172.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -72.81 -32.15 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.777 1.029 . . . . 10.0 113.777 -166.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 14.6 pt -137.11 143.89 43.85 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.069 0.948 . . . . 10.0 110.656 173.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.64 74.47 5.44 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.372 2.714 . . . . 10.0 112.941 -165.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.13 -100.72 0.18 Allowed Glycine 0 CA--C 1.524 0.611 0 C-N-CA 124.43 1.014 . . . . 10.0 111.554 166.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.8 m 51.04 93.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.03 2.532 . . . . 10.0 115.737 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -64.55 16.07 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 128.125 2.57 . . . . 10.0 115.271 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.5 ttt -69.76 90.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.302 1.441 . . . . 10.0 111.143 -178.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.34 69.58 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.607 1.963 . . . . 10.0 111.591 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -163.73 -42.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.943 1.697 . . . . 10.0 111.806 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.32 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 120.89 3.663 . . . . 10.0 120.89 178.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -166.39 147.09 11.61 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 121.427 1.922 . . . . 10.0 111.345 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.269 12.2 tt -71.23 -68.02 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.19 1.552 . . . . 10.0 115.19 -165.221 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.3 tttm -176.85 -51.25 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.156 1.782 . . . . 10.0 112.487 -179.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.449 ' HE3' ' HB ' ' A' ' 89' ' ' THR . 28.3 ttpt -164.24 146.87 9.12 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.947 2.099 . . . . 10.0 107.628 -160.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -58.84 -32.33 69.32 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 -176.146 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.449 ' HB ' ' HE3' ' A' ' 87' ' ' LYS . 4.9 m -61.67 -34.02 75.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.172 0.804 . . . . 10.0 113.172 174.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -76.3 -37.14 57.89 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.587 0.63 . . . . 10.0 111.73 171.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -55.15 -45.47 75.67 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.911 -1.118 . . . . 10.0 111.679 172.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -56.1 -53.89 51.58 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.623 1.169 . . . . 10.0 111.673 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.433 ' HB3' ' H1 ' ' A' ' 1' ' ' GLY . 2.2 p30 -60.21 -34.87 74.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.528 0.731 . . . . 10.0 112.804 -169.079 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.49 -44.72 90.1 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.162 -0.961 . . . . 10.0 112.99 172.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.65 -46.82 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 109.158 -0.682 . . . . 10.0 109.158 177.624 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.76 -55.58 32.37 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.782 0.833 . . . . 10.0 111.903 173.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -50.68 -60.82 2.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.353 1.861 . . . . 10.0 112.505 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.9 -20.21 58.21 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.365 1.246 . . . . 10.0 114.365 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.415 ' HE3' ' HA ' ' A' ' 99' ' ' LYS . 0.6 OUTLIER -67.32 -29.35 68.89 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.166 1.348 . . . . 10.0 112.271 168.324 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -69.76 -39.73 76.53 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 117.674 -1.155 . . . . 10.0 112.24 165.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.86 -9.0 2.48 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 116.22 1.933 . . . . 10.0 116.22 -178.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.634 ' HG1' ' ND2' ' A' ' 103' ' ' ASN . 22.7 p -94.59 7.36 45.95 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.96 1.304 . . . . 10.0 114.016 167.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.634 ' ND2' ' HG1' ' A' ' 102' ' ' THR . 69.3 m-80 -150.68 -15.42 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.322 1.449 . . . . 10.0 113.495 -163.167 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 C--O 1.255 1.367 0 C-N-CA 130.21 3.404 . . . . 10.0 107.964 179.716 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 CA-C-O 119.71 -0.494 . . . . 10.0 112.356 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -86.94 103.13 15.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.221 1.408 . . . . 10.0 111.825 -163.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.7 m -60.54 -16.0 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 114.161 1.171 . . . . 10.0 114.161 -175.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -69.59 -59.6 2.86 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.873 2.069 . . . . 10.0 111.693 167.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -53.75 -27.79 30.69 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.842 0.857 . . . . 10.0 112.254 170.252 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.18 -47.76 12.46 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.699 1.142 . . . . 10.0 111.863 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.89 -39.9 79.51 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.397 1.099 . . . . 10.0 112.231 177.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -40.6 81.5 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.739 -1.6 . . . . 10.0 111.504 178.285 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.5 -33.61 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 121.559 1.981 . . . . 10.0 111.062 173.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -57.18 -53.78 54.24 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 118.854 0.752 . . . . 10.0 110.425 170.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.52 -10.34 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 N-CA-C 113.677 0.992 . . . . 10.0 113.677 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -96.81 -38.28 9.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.66 1.984 . . . . 10.0 111.598 -176.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -125.66 -17.35 5.51 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 115.031 1.493 . . . . 10.0 115.031 -172.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.0 m -112.49 -39.88 4.25 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 125.07 1.348 . . . . 10.0 112.235 -172.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.07 -17.31 9.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.743 0.645 . . . . 10.0 112.743 170.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.36 -29.07 32.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.061 1.744 . . . . 10.0 113.052 166.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.7 m -145.34 11.3 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 126.52 1.928 . . . . 10.0 114.983 -177.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -149.38 -178.3 6.34 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.106 1.321 . . . . 10.0 111.385 -177.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -150.91 172.76 15.16 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.357 -1.464 . . . . 10.0 108.071 151.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -166.09 -41.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.623 1.569 . . . . 10.0 111.869 162.365 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.81 82.71 0.11 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.729 0.812 . . . . 10.0 109.181 172.081 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 56.41 -174.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.883 2.073 . . . . 10.0 111.206 -166.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.613 0 N-CA-C 116.956 1.543 . . . . 10.0 116.956 170.373 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 116.123 1.897 . . . . 10.0 116.123 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.09 -176.4 14.4 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 120.168 1.349 . . . . 10.0 113.842 174.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.39 -2.59 12.63 Favored 'Trans proline' 0 CA--C 1.536 0.585 1 C-N-CA 125.978 4.452 . . . . 10.0 115.885 -175.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.421 0.1 OUTLIER 43.56 158.0 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.847 2.859 . . . . 10.0 117.336 -154.818 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.38 24.42 1.16 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 119.749 -1.844 . . . . 10.0 113.875 -167.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.454 ' CD2' HE21 ' A' ' 42' ' ' GLN . 0.2 OUTLIER -57.28 98.96 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 130.001 3.32 . . . . 10.0 114.436 -166.334 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.53 7.72 61.55 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.468 1.033 . . . . 10.0 114.378 176.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.49 178.4 0.42 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.115 1.458 . . . . 10.0 110.569 168.672 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.25 18.0 m-85 63.69 26.2 14.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 10.0 113.939 -159.068 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 176.61 15.11 0.02 OUTLIER Glycine 0 CA--C 1.536 1.39 0 C-N-CA 126.141 1.829 . . . . 10.0 114.716 -175.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -153.15 160.26 42.83 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.074 1.437 . . . . 10.0 111.304 -168.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.5 pttm -81.05 160.1 24.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.609 1.564 . . . . 10.0 112.762 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 t -58.47 150.07 23.54 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.082 -0.386 . . . . 10.0 110.354 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.24 63.6 0.8 Allowed Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.261 0.934 . . . . 10.0 112.138 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.454 HE21 ' CD2' ' A' ' 33' ' ' HIS . 13.3 pt20 -154.21 -19.49 0.13 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -177.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 136.15 96.59 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 119.169 0.895 . . . . 10.0 112.163 -168.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.91 72.96 5.0 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.631 2.887 . . . . 10.0 113.074 -168.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.01 2.37 52.24 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.77 1.468 . . . . 10.0 116.77 165.171 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.64 155.16 34.22 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 119.178 1.489 . . . . 10.0 111.163 175.433 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 m -71.72 74.87 0.84 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.341 1.456 . . . . 10.0 113.42 -176.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -83.67 172.88 11.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.752 1.621 . . . . 10.0 111.935 166.2 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.9 p -77.3 172.98 12.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 121.254 -0.904 . . . . 10.0 111.526 167.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -69.23 -63.28 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.095 -1.003 . . . . 10.0 111.392 169.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.8 -39.46 65.49 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.899 1.28 . . . . 10.0 113.92 -160.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -61.86 -38.44 88.25 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.678 0.791 . . . . 10.0 112.942 178.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -77.19 -51.28 11.23 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.528 1.931 . . . . 10.0 110.701 173.834 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.36 -30.91 71.79 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.069 2.147 . . . . 10.0 113.32 -174.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 mmmm -159.99 16.58 0.14 Allowed 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.135 0.974 . . . . 10.0 113.391 -153.343 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.63 -133.61 0.67 Allowed Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.335 0.969 . . . . 10.0 111.878 163.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -170.23 -178.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.977 1.711 . . . . 10.0 110.521 -157.226 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 m -74.46 119.62 18.9 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.522 1.529 . . . . 10.0 111.194 172.437 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -77.14 62.07 2.16 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.461 1.504 . . . . 10.0 110.991 169.205 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -78.27 0.18 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 131.321 3.848 . . . . 10.0 115.643 -172.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 179.46 -9.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.992 2.917 . . . . 10.0 114.415 -176.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -81.82 -64.63 1.14 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.519 1.963 . . . . 10.0 112.857 160.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.8 p -54.74 -35.79 64.11 Favored 'General case' 0 N--CA 1.467 0.388 1 C-N-CA 132.078 4.151 . . . . 10.0 114.913 -165.613 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.6 mp -69.99 -24.56 63.33 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 117.606 -1.187 . . . . 10.0 113.103 175.327 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -41.91 68.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 120.55 1.523 . . . . 10.0 109.425 175.741 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -46.61 78.33 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.418 -0.513 . . . . 10.0 110.336 172.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -67.64 -43.6 79.93 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.711 1.004 . . . . 10.0 113.711 -174.712 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.35 -34.36 74.47 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.884 1.675 . . . . 10.0 112.572 177.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -76.36 -25.77 55.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.494 0.718 . . . . 10.0 112.694 177.147 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.58 74.63 2.11 Favored Pre-proline 0 CA--C 1.559 1.296 0 N-CA-C 113.275 0.842 . . . . 10.0 113.275 -178.25 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.29 -50.13 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.887 2.391 . . . . 10.0 112.487 -166.678 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -66.85 -22.26 65.99 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.798 1.639 . . . . 10.0 113.689 -178.747 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -75.41 -53.33 8.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.327 1.051 . . . . 10.0 110.274 166.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.34 -38.46 91.22 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.465 0.913 . . . . 10.0 113.465 -172.601 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.0 pt -131.69 117.72 16.48 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.773 0.829 . . . . 10.0 110.767 171.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.19 104.37 1.66 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.574 2.85 . . . . 10.0 111.798 -172.1 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.68 82.31 1.62 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.032 0.825 . . . . 10.0 111.594 178.189 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -133.22 -19.38 2.2 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.253 1.946 . . . . 10.0 116.253 -169.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 55.47 2.29 0.06 Allowed 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 117.039 2.236 . . . . 10.0 117.039 173.461 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.2 ttt -62.93 81.45 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 120.302 1.41 . . . . 10.0 110.081 161.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.49 90.26 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.956 1.303 . . . . 10.0 109.359 176.063 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -161.6 -68.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 118.32 -0.848 . . . . 10.0 112.825 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.17 89.08 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 127.237 2.215 . . . . 10.0 116.527 172.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.38 92.56 2.05 Favored Glycine 0 CA--C 1.532 1.101 0 O-C-N 121.691 -0.631 . . . . 10.0 113.179 175.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 17.8 tt -64.38 -36.82 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 115.808 1.781 . . . . 10.0 115.808 -167.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttm 164.41 -165.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 129.413 3.085 . . . . 10.0 108.501 -161.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.426 ' HE2' ' HG2' ' A' ' 90' ' ' GLU . 40.8 pttt -52.63 153.32 3.19 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.973 1.709 . . . . 10.0 110.91 167.088 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -73.16 71.45 1.16 Allowed 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 123.325 1.536 . . . . 10.0 110.774 171.656 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.3 m -151.89 -54.34 0.13 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 125.903 1.681 . . . . 10.0 108.259 169.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HG2' ' HE2' ' A' ' 87' ' ' LYS . 18.6 mm-40 -56.7 -38.83 72.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.762 0.71 . . . . 10.0 111.313 172.47 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -30.98 71.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.153 0.581 . . . . 10.0 111.907 174.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.05 -36.08 61.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.068 0.947 . . . . 10.0 111.239 173.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.59 -48.08 70.69 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.646 1.978 . . . . 10.0 111.186 175.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.23 -53.91 30.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.949 2.1 . . . . 10.0 112.668 174.681 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.26 -38.88 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 122.781 0.432 . . . . 10.0 110.274 -178.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.7 99.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 122.525 0.33 . . . . 10.0 111.647 173.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.6 -60.85 2.93 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.476 1.11 . . . . 10.0 111.195 172.287 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.04 -36.78 80.48 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.543 1.065 . . . . 10.0 112.728 -175.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.91 -32.57 61.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 117.891 -1.052 . . . . 10.0 112.721 174.478 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -101.13 -35.79 9.19 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 175.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.61 -27.53 64.77 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.969 1.713 . . . . 10.0 113.506 -178.262 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.9 t -65.38 -11.65 44.4 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.835 1.254 . . . . 10.0 114.363 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.71 51.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.031 2.132 . . . . 10.0 111.029 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 113.388 0.885 . . . . 10.0 113.388 172.026 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.29 119.88 19.25 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.814 1.246 . . . . 10.0 110.501 -161.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.24 -34.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 O-C-N 121.48 -0.763 . . . . 10.0 111.294 172.482 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.2 mp0 -60.72 -48.02 83.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 126.528 1.931 . . . . 10.0 111.164 -171.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mtmp? -75.68 -23.64 56.23 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.069 1.748 . . . . 10.0 113.568 167.579 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.27 -46.42 7.54 Favored Glycine 0 N--CA 1.464 0.555 0 O-C-N 121.236 -0.915 . . . . 10.0 111.78 -168.54 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -41.48 50.79 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.923 1.289 . . . . 10.0 113.408 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -71.72 -37.86 70.57 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.709 -1.139 . . . . 10.0 113.763 179.228 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.27 -35.61 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 120.372 1.442 . . . . 10.0 109.996 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 32.6 t80 -57.08 -51.11 70.61 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.222 0.919 . . . . 10.0 110.624 173.606 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.22 -16.63 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 113.968 1.099 . . . . 10.0 113.968 177.033 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.2 -34.76 25.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.535 1.134 . . . . 10.0 111.953 -173.768 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -136.53 -58.95 0.73 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.799 1.639 . . . . 10.0 110.334 -163.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 8.9 m -58.45 -45.9 87.64 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.806 1.243 . . . . 10.0 111.999 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -8.78 17.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.713 1.375 . . . . 10.0 114.713 175.497 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -10.22 59.48 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.01 -1.056 . . . . 10.0 112.412 169.774 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 87.3 m -142.87 -27.55 0.58 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -173.024 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -116.72 168.12 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.333 2.253 . . . . 10.0 112.956 -176.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -136.07 137.78 41.45 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.859 1.263 . . . . 10.0 109.855 165.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.2 p -166.26 -32.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.923 1.289 . . . . 10.0 111.738 172.364 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -48.21 -38.06 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.36 2.264 . . . . 10.0 115.311 175.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.46 148.47 16.38 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.489 1.916 . . . . 10.0 108.14 168.346 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.197 0 CA-C-O 121.583 0.546 . . . . 10.0 112.05 -172.336 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.472 0.653 0 CA-C-O 118.873 -0.584 . . . . 10.0 111.604 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.97 167.06 22.97 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 109.782 -1.327 . . . . 10.0 109.782 149.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.0 155.49 52.78 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 10.0 112.135 179.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.69 129.68 40.73 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.068 -1.02 . . . . 10.0 109.82 165.543 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.32 70.36 2.92 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.571 1.653 . . . . 10.0 112.592 -167.311 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.65 88.61 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.583 1 C-N-CA 132.576 4.35 . . . . 10.0 115.112 -178.931 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.58 27.23 70.62 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.245 0.926 . . . . 10.0 114.938 162.652 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.5 mp -53.37 166.06 0.31 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.834 1.654 . . . . 10.0 111.905 178.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 29.1 m-85 65.36 59.37 0.8 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.007 1.723 . . . . 10.0 113.246 -174.067 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 161.35 -46.01 0.38 Allowed Glycine 0 CA--C 1.53 0.986 0 CA-C-N 115.533 -0.758 . . . . 10.0 114.187 167.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.11 169.51 13.06 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.976 0.91 . . . . 10.0 112.13 177.086 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.1 pttm -74.74 -20.52 59.79 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 115.055 1.502 . . . . 10.0 115.055 -165.828 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.435 HG21 ' CD1' ' A' ' 59' ' ' TRP 0.288 29.6 p 88.05 167.5 0.06 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 129.417 3.087 . . . . 10.0 112.659 175.449 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 70.21 116.77 0.04 OUTLIER Glycine 0 CA--C 1.541 1.664 0 C-N-CA 123.109 0.385 . . . . 10.0 112.217 -154.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -159.45 4.87 0.09 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.393 1.877 . . . . 10.0 113.861 168.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -50.86 108.98 1.16 Allowed Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 125.966 1.707 . . . . 10.0 114.651 -164.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.6 65.61 8.09 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.386 3.391 . . . . 10.0 112.944 -171.459 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 107.64 60.26 0.56 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.798 1.19 . . . . 10.0 113.171 174.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -143.81 169.66 17.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.182 1.393 . . . . 10.0 109.607 177.286 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -153.25 151.79 30.44 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.585 0.754 . . . . 10.0 110.772 177.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.76 -92.89 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 10.0 111.22 -153.899 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -145.8 -1.64 0.77 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.129 2.172 . . . . 10.0 114.106 -177.006 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 45.46 -95.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.923 2.089 . . . . 10.0 112.613 -157.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 30.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.697 3.199 . . . . 10.0 115.558 170.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -43.95 -56.61 3.82 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.782 2.033 . . . . 10.0 111.695 174.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.01 -40.09 94.49 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.263 1.825 . . . . 10.0 111.087 -177.397 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -63.41 -48.6 77.13 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.227 1.411 . . . . 10.0 111.533 176.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -62.18 -24.09 66.99 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.714 1.206 . . . . 10.0 113.701 -174.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.4 36.66 93.68 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.375 0.989 . . . . 10.0 114.184 171.083 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -1.44 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.869 2.067 . . . . 10.0 116.084 -174.486 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.8 m 56.27 92.59 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.606 1.963 . . . . 10.0 113.184 -179.689 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.435 ' CD1' HG21 ' A' ' 40' ' ' THR . 10.5 m95 -58.68 125.75 24.75 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.427 168.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 0.6 OUTLIER -162.76 178.62 8.31 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.782 2.833 . . . . 10.0 109.177 -178.237 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -67.17 35.36 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 129.637 3.175 . . . . 10.0 114.574 -172.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -160.89 -63.8 0.06 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 127.904 2.482 . . . . 10.0 108.432 -174.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.5 p -57.92 -46.93 84.25 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.116 1.366 . . . . 10.0 111.673 179.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.44 -29.09 66.72 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.563 1.145 . . . . 10.0 111.783 175.519 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 30.3 ttm -68.77 -43.69 75.24 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 118.275 0.489 . . . . 10.0 111.105 175.663 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -67.91 -45.79 73.37 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 117.908 0.322 . . . . 10.0 110.184 173.305 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.5 -57.72 11.53 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 118.107 -0.949 . . . . 10.0 112.45 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -34.05 76.72 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.549 1.522 . . . . 10.0 111.904 -174.573 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -73.02 -22.05 60.72 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.634 1.716 . . . . 10.0 115.634 175.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -161.47 63.15 1.61 Allowed Pre-proline 0 CA--C 1.556 1.189 0 CA-C-N 120.156 1.344 . . . . 10.0 114.384 178.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.208 1.939 . . . . 10.0 113.072 -159.18 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -71.17 -20.47 62.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.703 2.001 . . . . 10.0 112.745 -178.248 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.23 -51.99 10.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.521 1.129 . . . . 10.0 110.231 164.149 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -60.49 -44.99 95.37 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.87 1.063 . . . . 10.0 113.87 -173.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 pt -137.08 124.35 14.07 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.992 . . . . 10.0 110.436 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -78.07 60.24 7.28 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.407 3.405 . . . . 10.0 112.696 -167.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.85 66.38 0.04 OUTLIER Glycine 0 CA--C 1.523 0.584 0 O-C-N 121.567 -0.708 . . . . 10.0 113.338 179.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 4.5 m -135.91 125.35 25.0 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.886 0.874 . . . . 10.0 111.871 173.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -86.39 -3.53 59.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.783 1.401 . . . . 10.0 114.783 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.1 ttt -50.11 101.83 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.972 1.709 . . . . 10.0 113.7 -174.816 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 27.3 mm -78.22 72.96 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.224 1.41 . . . . 10.0 109.583 175.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -163.58 -49.42 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.851 1.26 . . . . 10.0 111.139 169.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.93 32.53 1.35 Allowed 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 118.081 2.623 . . . . 10.0 118.081 164.52 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 179.0 -161.11 27.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.965 1.269 . . . . 10.0 111.441 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.2 tt -147.68 -175.37 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.554 0.742 . . . . 10.0 111.71 165.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -77.89 -30.47 50.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.939 1.296 . . . . 10.0 114.492 -164.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -161.63 -68.96 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 116.588 -1.672 . . . . 10.0 111.755 -170.069 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 pttm 174.98 -40.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.777 2.031 . . . . 10.0 115.815 164.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 m -58.39 -30.3 66.71 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.732 1.606 . . . . 10.0 112.04 -178.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.3 mp0 -59.42 -29.08 67.5 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.23 -0.919 . . . . 10.0 112.366 173.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -55.57 13.66 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 119.189 0.904 . . . . 10.0 111.63 -178.476 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -61.06 -34.67 75.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.933 1.293 . . . . 10.0 111.618 175.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -67.33 -45.9 75.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.145 0.884 . . . . 10.0 112.545 174.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.14 -38.36 90.36 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.334 -0.854 . . . . 10.0 113.019 174.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mt -61.16 -51.21 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 118.566 -0.73 . . . . 10.0 109.6 170.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -41.64 85.31 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.876 0.762 . . . . 10.0 112.557 177.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -50.36 -65.73 0.51 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 124.407 1.083 . . . . 10.0 111.557 169.414 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.4 -36.01 82.3 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.491 0.587 . . . . 10.0 112.131 -175.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -65.75 -21.61 66.53 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.423 1.489 . . . . 10.0 114.263 176.029 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -87.79 -52.56 5.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.466 1.03 . . . . 10.0 111.422 160.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -26.05 52.97 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 -170.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.5 t -74.11 -1.86 22.03 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.42 1.488 . . . . 10.0 114.126 172.674 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -154.08 -18.61 0.13 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 117.12 2.267 . . . . 10.0 117.12 -178.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.074 -1.917 . . . . 10.0 114.561 177.952 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 CA-C-O 118.828 -0.984 . . . . 10.0 111.347 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -140.74 160.12 40.73 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.287 1.588 . . . . 10.0 115.287 -149.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.17 -53.0 54.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 125.817 1.647 . . . . 10.0 112.749 -179.22 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -44.45 97.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.786 1.176 . . . . 10.0 113.335 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -56.13 -36.22 68.0 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.675 0.75 . . . . 10.0 110.793 172.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.37 -51.42 6.7 Favored Glycine 0 C--O 1.224 -0.512 0 C-N-CA 125.248 1.404 . . . . 10.0 110.288 -173.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -37.52 83.38 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.111 1.456 . . . . 10.0 112.637 177.248 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -59.94 -56.79 17.33 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.625 0.77 . . . . 10.0 111.594 174.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -31.76 47.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 118.438 0.563 . . . . 10.0 111.816 -178.45 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -56.41 -51.08 69.69 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.371 -1.455 . . . . 10.0 110.576 168.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.68 -15.53 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 113.682 0.993 . . . . 10.0 113.682 178.375 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -90.09 -43.6 10.38 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.025 1.33 . . . . 10.0 111.78 -179.631 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -119.2 -11.37 9.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.932 1.456 . . . . 10.0 114.932 -169.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -120.32 -44.17 2.49 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.451 1.5 . . . . 10.0 111.434 -172.345 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.31 -11.17 20.03 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.696 0.998 . . . . 10.0 113.696 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.25 -25.95 26.18 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.953 2.101 . . . . 10.0 112.553 164.04 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.8 m -141.68 -19.29 0.75 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 10.0 113.629 -173.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.419 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 92.3 m-70 -130.25 86.16 2.37 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 10.0 110.897 -177.067 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.2 p -69.69 18.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.574 2.064 . . . . 10.0 116.574 -167.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.71 -35.07 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 O-C-N 120.642 -1.286 . . . . 10.0 113.509 -160.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -62.99 -0.84 0.76 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.131 1.772 . . . . 10.0 114.271 177.077 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -150.28 13.68 0.77 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.109 2.164 . . . . 10.0 111.561 178.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.126 0 C-N-CA 125.137 1.351 . . . . 10.0 112.312 -169.686 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.477 0.925 0 CA-C-O 118.254 -0.879 . . . . 10.0 113.248 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.419 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -124.98 170.99 16.95 Favored Glycine 0 CA--C 1.54 1.653 0 CA-C-N 119.657 1.117 . . . . 10.0 111.95 167.125 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.24 44.18 1.6 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 124.908 3.739 . . . . 10.0 113.969 -153.197 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 48.14 18.84 0.16 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.172 2.189 . . . . 10.0 115.963 -178.378 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt 33.37 64.6 0.3 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.964 2.905 . . . . 10.0 112.835 -179.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -54.11 80.48 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.83 2.452 . . . . 10.0 111.748 172.098 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.04 -47.89 0.07 OUTLIER Glycine 0 CA--C 1.536 1.358 0 C-N-CA 129.827 3.584 . . . . 10.0 116.237 -179.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.276 8.6 mp 53.78 -148.8 0.44 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.533 1.933 . . . . 10.0 110.295 -165.67 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 34.8 59.52 0.68 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.148 2.179 . . . . 10.0 114.959 178.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 115.81 -27.2 8.43 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.693 2.092 . . . . 10.0 113.17 -174.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -69.49 74.26 0.38 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.071 1.348 . . . . 10.0 111.344 170.087 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt 34.03 -125.25 0.09 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 129.927 3.291 . . . . 10.0 113.776 161.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.7 m -149.52 -79.62 0.13 Allowed 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.163 -1.585 . . . . 10.0 109.742 171.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.59 88.47 0.73 Allowed Glycine 0 CA--C 1.535 1.296 0 O-C-N 120.357 -1.464 . . . . 10.0 115.541 179.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -134.4 9.53 3.72 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.452 1.279 . . . . 10.0 114.452 -178.085 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.8 140.34 93.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 121.031 -1.043 . . . . 10.0 112.266 -176.735 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -77.61 52.34 3.91 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 124.104 3.203 . . . . 10.0 112.876 -177.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.88 -96.49 0.37 Allowed Glycine 0 CA--C 1.527 0.785 0 C-N-CA 126.347 1.927 . . . . 10.0 110.869 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.7 t80 32.8 100.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.758 2.823 . . . . 10.0 117.234 165.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 m -66.33 90.25 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.168 -0.957 . . . . 10.0 112.258 168.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -83.13 174.0 11.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.298 1.439 . . . . 10.0 110.447 161.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.0 p -74.42 30.88 0.08 Allowed 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -174.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.5 t70 45.73 -69.02 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 129.849 3.259 . . . . 10.0 115.593 -166.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.04 -45.73 61.4 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.026 1.73 . . . . 10.0 113.552 -150.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -45.9 -70.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.38 1.472 . . . . 10.0 111.748 171.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -71.19 -25.37 62.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.581 1.552 . . . . 10.0 112.447 -171.197 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.56 -45.93 92.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.51 1.524 . . . . 10.0 112.697 161.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.71 -24.13 65.35 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.27 0.941 . . . . 10.0 113.184 -170.198 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.77 26.9 70.19 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-O 119.1 -0.833 . . . . 10.0 115.072 163.46 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -3.96 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 115.847 1.795 . . . . 10.0 115.847 -171.615 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.4 m 57.86 108.9 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.565 2.346 . . . . 10.0 114.002 -170.551 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -67.24 119.76 12.67 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.284 -0.871 . . . . 10.0 112.349 173.067 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -166.63 -175.92 3.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.742 2.817 . . . . 10.0 108.768 175.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -45.59 -53.08 9.63 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.645 1.578 . . . . 10.0 111.635 176.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.67 15.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.862 2.065 . . . . 10.0 116.047 -174.833 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.9 p -157.73 -39.26 0.07 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.94 -1.1 . . . . 10.0 110.879 -169.221 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -30.19 59.65 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.181 1.355 . . . . 10.0 112.787 174.841 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -51.03 58.46 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 119.613 1.097 . . . . 10.0 108.616 174.743 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.81 -37.74 87.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.506 0.722 . . . . 10.0 110.653 -179.807 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -66.06 -65.38 0.68 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.403 -0.808 . . . . 10.0 112.561 173.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -17.26 64.71 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.818 1.645 . . . . 10.0 114.301 -172.756 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.93 -32.05 71.38 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.806 1.185 . . . . 10.0 113.557 165.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -163.23 79.31 1.67 Allowed Pre-proline 0 CA--C 1.549 0.933 0 CA-C-N 119.754 1.161 . . . . 10.0 111.642 177.262 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 73' ' ' LYS . 37.7 Cg_endo -69.36 -52.25 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.189 1.926 . . . . 10.0 110.873 -163.919 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -67.78 24.88 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.767 2.827 . . . . 10.0 114.568 -177.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' A' ' 71' ' ' PRO . 0.1 OUTLIER -160.91 -28.8 0.06 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.921 2.089 . . . . 10.0 111.894 -175.081 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -64.62 -38.6 91.56 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 119.273 0.942 . . . . 10.0 112.006 165.376 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.4 pt -133.78 151.08 76.34 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 124.239 1.016 . . . . 10.0 111.381 176.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.1 162.2 41.36 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.725 2.284 . . . . 10.0 111.213 173.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 39.7 61.85 1.51 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.955 1.74 . . . . 10.0 114.775 172.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.9 t -121.08 -14.41 8.41 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.101 1.519 . . . . 10.0 115.101 178.198 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? 54.5 -67.14 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 127.668 2.387 . . . . 10.0 116.071 179.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.1 ttt 13.53 85.17 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 130.961 3.704 . . . . 10.0 113.838 -177.15 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -70.53 80.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.856 1.263 . . . . 10.0 109.553 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -162.95 -51.83 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.455 1.502 . . . . 10.0 111.19 172.086 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 35.15 57.6 0.79 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.845 2.458 . . . . 10.0 116.449 170.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 161.41 -166.96 36.11 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.457 1.027 . . . . 10.0 111.594 179.446 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 tt -158.08 178.15 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.826 1.65 . . . . 10.0 109.475 166.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -88.9 166.96 13.61 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.844 1.202 . . . . 10.0 111.047 178.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.468 ' HG3' ' H ' ' A' ' 88' ' ' LYS 0.258 8.6 ptpp? 40.21 -103.53 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.602 1.961 . . . . 10.0 112.153 -172.522 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.468 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 49.2 tttp -163.17 -32.95 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.828 1.251 . . . . 10.0 112.578 154.003 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.9 m -59.06 -21.39 59.09 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 -178.882 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -54.64 -32.77 59.57 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.067 -1.021 . . . . 10.0 112.354 167.444 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.35 -22.36 61.17 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.226 1.411 . . . . 10.0 112.744 175.423 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.26 -53.91 7.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.238 1.015 . . . . 10.0 110.402 164.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.65 1.58 . . . . 10.0 111.735 -169.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 mp -53.69 -42.95 68.52 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 114.499 1.296 . . . . 10.0 114.499 173.668 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.8 mm -66.09 -50.86 66.06 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.238 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.132 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.42 66.28 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.916 -1.04 . . . . 10.0 113.301 179.471 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -66.51 -69.2 0.32 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.67 1.988 . . . . 10.0 112.557 159.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.79 -20.6 63.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.085 0.772 . . . . 10.0 113.085 -173.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.17 -35.52 62.4 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.883 2.073 . . . . 10.0 113.371 166.815 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -81.27 -46.0 15.42 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.037 1.335 . . . . 10.0 110.874 171.399 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.2 -1.02 0.27 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.453 2.39 . . . . 10.0 117.453 -166.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.7 t -133.85 15.42 3.94 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.838 1.255 . . . . 10.0 114.227 168.4 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -151.02 -13.48 0.22 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.767 1.627 . . . . 10.0 114.172 -169.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.949 1.699 . . . . 10.0 114.25 177.214 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.942 0 CA-C-O 117.914 -1.492 . . . . 10.0 111.792 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -139.53 164.59 29.48 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.119 1.459 . . . . 10.0 114.823 -173.601 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.4 t -75.29 -61.22 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 126.281 1.832 . . . . 10.0 109.879 165.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -60.0 -47.36 86.14 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.986 -1.071 . . . . 10.0 113.531 -175.236 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -59.16 -31.47 69.01 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 117.871 0.305 . . . . 10.0 111.226 172.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.23 -50.94 19.82 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 125.858 1.694 . . . . 10.0 111.379 178.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -32.7 74.36 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 117.879 0.84 . . . . 10.0 111.813 -179.337 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -63.26 -55.2 26.84 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.802 1.241 . . . . 10.0 111.413 173.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.251 0.2 OUTLIER -68.3 -30.17 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 CA-C-N 118.473 0.579 . . . . 10.0 111.747 -179.474 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -56.35 -54.06 49.93 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 120.468 -1.395 . . . . 10.0 110.83 164.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.2 t -62.23 -13.93 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 O-C-N 121.308 -0.87 . . . . 10.0 113.209 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -91.93 -42.16 10.19 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.641 1.177 . . . . 10.0 112.285 178.508 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -124.44 -3.06 7.93 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.63 1.715 . . . . 10.0 115.63 -168.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.7 m -120.67 -43.9 2.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.909 1.684 . . . . 10.0 111.0 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.64 -4.37 8.62 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.493 1.294 . . . . 10.0 114.493 176.304 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.47 -12.38 60.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.64 1.176 . . . . 10.0 113.964 164.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.63 -40.57 0.29 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.622 1.569 . . . . 10.0 112.49 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.456 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.5 m-70 -93.68 -161.61 0.86 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 127.504 2.322 . . . . 10.0 109.034 166.246 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 m -154.8 -55.07 0.1 Allowed 'General case' 0 N--CA 1.482 1.175 0 O-C-N 119.847 -1.783 . . . . 10.0 112.574 165.281 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t 61.2 -71.75 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.085 1.754 . . . . 10.0 114.422 177.568 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.35 -52.75 64.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.342 1.057 . . . . 10.0 111.769 -166.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -153.17 100.27 2.45 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.953 1.301 . . . . 10.0 110.582 -171.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.255 0 N-CA-C 117.003 1.561 . . . . 10.0 117.003 165.505 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.456 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -148.89 156.61 26.92 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-N 120.681 1.582 . . . . 10.0 112.328 167.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.99 3.91 3.6 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 124.79 3.66 . . . . 10.0 117.088 -151.04 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 64.32 149.12 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.482 2.713 . . . . 10.0 112.654 -144.646 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -83.54 50.0 1.7 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.647 1.179 . . . . 10.0 110.691 176.135 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.46 98.45 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 128.267 2.627 . . . . 10.0 113.821 -173.92 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 17.96 68.02 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.562 1.077 . . . . 10.0 114.651 173.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -61.06 172.28 1.05 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 118.914 1.357 . . . . 10.0 112.015 179.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.281 77.5 m-85 71.38 68.25 0.16 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.395 1.878 . . . . 10.0 111.614 -163.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.2 -23.45 5.19 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 126.731 2.11 . . . . 10.0 113.215 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mtp85 -77.68 162.51 26.95 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.401 1.096 . . . . 10.0 112.557 173.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 179.02 4.42 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.459 2.304 . . . . 10.0 111.765 171.74 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.3 p -73.82 174.87 7.86 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.295 1.038 . . . . 10.0 109.439 161.294 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.39 -179.37 37.52 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-O 121.788 0.66 . . . . 10.0 111.717 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 65.32 166.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.563 1.945 . . . . 10.0 114.696 -176.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 162.36 167.38 0.05 OUTLIER Pre-proline 0 CA--C 1.546 0.824 1 C-N-CA 133.216 4.607 . . . . 10.0 105.212 -169.222 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.77 -143.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.55 1.318 0 C-N-CA 122.538 2.159 . . . . 10.0 108.927 146.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.88 18.94 0.17 Allowed Glycine 0 CA--C 1.544 1.862 0 N-CA-C 117.447 1.739 . . . . 10.0 117.447 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -77.35 106.06 8.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.443 1.622 . . . . 10.0 110.893 175.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 m -65.61 138.64 58.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.13 1.372 . . . . 10.0 111.567 173.435 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.449 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.46 -178.94 6.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.519 1.528 . . . . 10.0 112.3 -175.126 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.3 p -71.78 164.35 26.15 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.203 0.601 . . . . 10.0 111.805 167.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -75.48 -111.24 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.236 -0.915 . . . . 10.0 109.847 163.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 35.81 -87.34 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 130.086 3.354 . . . . 10.0 115.051 168.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -45.82 -56.97 4.7 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.209 1.403 . . . . 10.0 112.738 170.428 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.449 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -63.5 -35.78 81.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.227 0.611 . . . . 10.0 111.27 -175.71 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.21 -43.76 85.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.643 2.377 . . . . 10.0 113.417 172.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -21.94 55.09 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.851 1.797 . . . . 10.0 115.851 -167.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.06 -7.54 63.08 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 116.24 1.256 . . . . 10.0 116.24 159.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.6 pp -56.77 141.71 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 118.61 1.205 . . . . 10.0 111.966 -177.081 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.8 m -67.83 117.9 10.34 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 121.641 -0.662 . . . . 10.0 110.013 -178.288 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -71.18 113.55 8.33 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 170.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.62 179.52 7.14 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 10.0 111.887 -168.642 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -69.74 42.91 0.05 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.279 1.831 . . . . 10.0 115.207 -172.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -160.23 -66.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.132 2.173 . . . . 10.0 108.254 -176.372 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.0 p -57.22 -38.24 73.45 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 126.594 1.958 . . . . 10.0 112.731 -179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.57 -23.25 56.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 10.0 113.035 176.772 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -51.91 30.63 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.151 1.341 . . . . 10.0 108.466 169.454 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.2 -43.72 98.43 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 123.431 0.457 . . . . 10.0 110.315 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.61 -57.88 10.83 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 118.304 -0.855 . . . . 10.0 111.931 175.298 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.76 -28.79 67.11 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 120.288 1.404 . . . . 10.0 113.645 -172.114 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -78.88 -19.58 51.58 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.521 1.304 . . . . 10.0 114.521 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.4 60.73 1.43 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.37 1.068 . . . . 10.0 110.856 -167.681 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.95 -58.85 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.519 2.146 . . . . 10.0 111.343 -168.142 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -70.63 38.2 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 129.034 2.934 . . . . 10.0 113.174 179.206 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.07 -49.52 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 128.391 2.676 . . . . 10.0 108.828 -169.391 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -62.18 -36.78 82.92 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.907 0.321 . . . . 10.0 111.539 174.684 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.82 154.59 73.01 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 126.163 1.785 . . . . 10.0 108.72 166.122 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.43 164.81 34.52 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 121.65 1.566 . . . . 10.0 110.425 165.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.32 66.84 2.33 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.184 -0.787 . . . . 10.0 114.208 168.356 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -129.49 -33.26 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.786 1.773 . . . . 10.0 115.786 172.68 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 62.78 -63.26 0.11 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 116.954 -1.498 . . . . 10.0 113.889 -170.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.1 ttt 10.27 91.29 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 129.715 3.206 . . . . 10.0 114.512 -173.098 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 19.9 mm -72.51 74.2 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 125.376 1.47 . . . . 10.0 110.895 -175.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -163.29 -49.46 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.615 1.566 . . . . 10.0 112.101 169.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.83 78.62 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.717 2.407 . . . . 10.0 115.576 172.876 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.62 -159.48 25.86 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.206 1.384 . . . . 10.0 112.916 -176.675 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.9 tt -153.84 -178.66 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.376 1.47 . . . . 10.0 109.812 157.046 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -76.36 -87.2 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.804 1.242 . . . . 10.0 114.003 -166.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -65.74 0.9 Allowed 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.669 1.577 . . . . 10.0 111.342 -176.107 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.6 pttt 174.57 -61.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.905 2.482 . . . . 10.0 111.721 176.574 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.4 m -59.46 -20.72 57.36 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 -173.209 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -56.3 -26.99 54.06 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.081 0.855 . . . . 10.0 112.529 168.485 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -50.07 75.21 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 125.025 1.33 . . . . 10.0 110.898 172.285 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -62.72 -48.36 79.58 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.052 1.341 . . . . 10.0 110.222 176.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -59.88 -48.62 80.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.516 1.126 . . . . 10.0 111.773 -172.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mp -54.99 -49.64 70.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.19 0.811 . . . . 10.0 113.19 173.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.2 mm -62.67 -45.76 98.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 123.264 0.625 . . . . 10.0 109.69 -178.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.88 -46.86 86.84 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.817 1.247 . . . . 10.0 112.236 174.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.12 -59.95 4.19 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.875 0.87 . . . . 10.0 111.273 173.988 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.24 -37.95 89.3 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -173.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -62.06 -24.45 67.1 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.04 0.936 . . . . 10.0 112.852 176.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.51 -59.06 2.49 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.517 1.527 . . . . 10.0 111.896 165.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.61 -32.52 63.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.63 1.572 . . . . 10.0 114.588 -171.361 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -54.61 -32.27 58.52 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 174.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -87.93 -20.3 26.11 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.171 1.388 . . . . 10.0 114.372 177.957 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 116.128 -1.892 . . . . 10.0 112.939 -140.714 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 110.063 -1.215 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.446 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.7 OUTLIER -134.03 96.17 3.58 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.231 1.413 . . . . 10.0 107.447 -152.579 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.9 p -49.49 -39.02 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.679 1.592 . . . . 10.0 113.853 -162.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 53.4 mp0 -71.13 -32.65 69.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.85 1.26 . . . . 10.0 113.987 178.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.3 mttt -75.68 -28.31 58.61 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 125.252 1.421 . . . . 10.0 111.436 174.53 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.61 -42.42 93.45 Favored Glycine 0 C--N 1.334 0.462 0 N-CA-C 109.951 -1.26 . . . . 10.0 109.951 -173.36 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -62.87 -41.52 99.42 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.85 0.685 . . . . 10.0 112.85 173.099 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -62.21 -54.86 34.84 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.812 1.645 . . . . 10.0 111.323 179.406 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 tp -69.23 -33.4 57.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 122.637 0.375 . . . . 10.0 111.577 -179.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -57.67 -49.7 75.61 Favored 'General case' 0 C--N 1.344 0.356 0 O-C-N 121.663 -0.648 . . . . 10.0 110.672 168.335 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.41 -15.52 10.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.054 -1.029 . . . . 10.0 113.72 178.567 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -92.69 -41.8 9.96 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.291 1.037 . . . . 10.0 112.644 -179.527 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -117.94 -11.12 10.29 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.749 1.389 . . . . 10.0 114.749 -171.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.4 m -122.64 -45.94 2.15 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.404 1.482 . . . . 10.0 111.239 -169.739 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.94 -16.4 42.07 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 175.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -20.62 10.42 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 129.996 3.318 . . . . 10.0 113.699 166.464 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.9 m -142.46 -15.29 0.75 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.763 2.025 . . . . 10.0 113.443 178.413 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -133.43 62.11 1.66 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.691 2.397 . . . . 10.0 109.854 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -64.42 114.93 4.64 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.597 -1.314 . . . . 10.0 109.943 -177.293 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.5 t -140.9 -49.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.675 1.19 . . . . 10.0 111.676 -160.791 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.12 -10.36 1.17 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.021 1.328 . . . . 10.0 113.912 -177.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -150.15 15.56 0.82 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.486 2.714 . . . . 10.0 110.437 -179.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.379 0 C-N-CA 127.501 2.477 . . . . 10.0 115.232 -174.902 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -152.38 169.46 31.58 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.213 1.387 . . . . 10.0 110.648 171.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -72.29 9.62 1.13 Allowed 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.983 3.122 . . . . 10.0 115.238 -169.468 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 47.14 162.1 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 129.566 3.146 . . . . 10.0 114.39 -149.408 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -80.43 76.08 7.26 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.117 -0.99 . . . . 10.0 108.395 170.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -65.6 -174.01 0.18 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.929 1.292 . . . . 10.0 110.814 166.273 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.22 119.79 2.07 Favored Glycine 0 CA--C 1.537 1.426 0 O-C-N 121.24 -0.913 . . . . 10.0 112.205 166.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.45 -165.34 1.49 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 129.636 3.175 . . . . 10.0 109.137 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.309 76.6 m-85 63.4 -17.38 0.06 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.313 3.045 . . . . 10.0 118.774 173.075 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -138.69 -25.7 0.31 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 127.092 2.282 . . . . 10.0 113.432 163.539 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.4 170.28 12.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.946 1.299 . . . . 10.0 113.159 177.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.18 161.79 17.86 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.962 -1.086 . . . . 10.0 113.395 177.318 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.5 m -77.79 144.09 37.41 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.699 1.6 . . . . 10.0 110.539 179.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.18 0.39 65.69 Favored Glycine 0 N--CA 1.472 1.098 0 N-CA-C 115.652 1.021 . . . . 10.0 115.652 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -71.19 49.28 0.14 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 127.208 2.203 . . . . 10.0 113.81 -179.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.26 137.24 71.91 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 128.169 2.588 . . . . 10.0 113.394 -178.263 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.63 46.55 1.89 Allowed 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 123.505 2.803 . . . . 10.0 112.758 173.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.55 80.39 1.18 Allowed Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.628 1.585 . . . . 10.0 114.732 173.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -153.07 125.69 8.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.539 1.135 . . . . 10.0 111.425 173.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -79.93 87.78 5.34 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.851 1.261 . . . . 10.0 111.897 179.1 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.83 176.86 8.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.48 1.512 . . . . 10.0 112.513 166.25 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.62 131.06 45.91 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.684 1.994 . . . . 10.0 109.898 158.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -75.13 -159.66 0.1 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.128 0.971 . . . . 10.0 111.67 172.329 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.38 -69.49 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.658 1.983 . . . . 10.0 113.524 -169.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.43 ' ND2' ' H ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -51.23 -51.36 54.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.383 1.873 . . . . 10.0 112.747 174.43 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.43 ' H ' ' ND2' ' A' ' 52' ' ' ASN . 1.8 mmpt? -72.1 -42.59 65.92 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.592 1.157 . . . . 10.0 113.107 170.584 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.6 -41.19 69.65 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.812 0.845 . . . . 10.0 112.75 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.85 -11.62 60.43 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.379 1.252 . . . . 10.0 114.379 176.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.97 9.02 55.77 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 118.182 2.033 . . . . 10.0 118.182 151.397 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.8 pp -40.64 10.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.236 2 C-N-CA 135.274 5.43 . . . . 10.0 121.893 -154.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.3 m 57.03 109.67 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 128.361 2.664 . . . . 10.0 114.646 -173.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -71.28 134.53 46.87 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.575 -1.193 . . . . 10.0 112.091 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -164.89 173.59 11.51 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 131.135 3.774 . . . . 10.0 105.595 173.12 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -57.6 -36.0 71.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 120.442 1.474 . . . . 10.0 114.036 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.97 -54.7 34.35 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.994 1.27 . . . . 10.0 111.165 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.8 p -65.77 -38.94 90.42 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.761 0.825 . . . . 10.0 111.928 -179.347 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.13 -27.61 59.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.497 1.044 . . . . 10.0 113.471 175.14 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 19.1 mtm -63.5 -53.45 51.82 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.154 1.343 . . . . 10.0 109.274 170.426 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -59.44 -45.82 90.49 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.916 0.76 . . . . 10.0 109.582 179.138 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -65.36 -48.35 73.27 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.59 -0.719 . . . . 10.0 112.762 -179.163 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.38 -29.45 67.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 120.849 1.659 . . . . 10.0 112.103 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -80.07 -22.82 41.84 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.727 1.38 . . . . 10.0 114.727 174.848 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.99 84.59 1.43 Allowed Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.218 1.407 . . . . 10.0 114.431 169.038 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.27 -49.03 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.364 2.043 . . . . 10.0 113.364 -165.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -71.66 -32.6 68.08 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.618 1.567 . . . . 10.0 111.519 -172.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -71.36 -41.84 69.22 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.603 1.161 . . . . 10.0 111.864 168.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -64.88 -48.92 72.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.18 0.9 . . . . 10.0 113.231 178.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 10.2 pt -128.75 102.39 19.79 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.688 0.795 . . . . 10.0 110.763 173.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.19 136.32 40.16 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.513 2.142 . . . . 10.0 110.752 -177.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.3 -32.39 5.09 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.581 1.562 . . . . 10.0 113.255 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m -50.44 -24.79 3.32 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 118.784 2.883 . . . . 10.0 118.784 -165.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.29 -82.69 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 116.914 -1.517 . . . . 10.0 111.602 -162.174 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.2 ttt 31.25 95.47 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.398 2.679 . . . . 10.0 113.893 -169.026 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.7 mt -71.69 45.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 C-N-CA 126.772 2.029 . . . . 10.0 112.759 -175.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -163.45 86.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.245 2.218 . . . . 10.0 108.847 178.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.23 -13.73 62.3 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.138 1.532 . . . . 10.0 115.138 -170.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.3 165.12 31.52 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.655 1.121 . . . . 10.0 111.84 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.3 tt -95.08 170.36 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.061 1.345 . . . . 10.0 111.968 -178.199 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -45.68 -45.32 14.07 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.616 2.366 . . . . 10.0 114.604 -167.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -164.55 177.87 7.79 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.945 2.498 . . . . 10.0 108.661 168.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -64.36 -27.92 69.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.332 1.605 . . . . 10.0 115.332 -171.26 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.33 -49.95 74.48 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.935 1.698 . . . . 10.0 112.025 -179.824 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -76.66 -6.61 52.78 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.195 1.798 . . . . 10.0 114.569 172.236 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER -78.76 -36.1 43.56 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.634 -1.916 . . . . 10.0 112.502 156.591 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -69.16 -42.69 75.58 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.69 -1.256 . . . . 10.0 111.002 174.661 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.446 ' CB ' ' H ' ' A' ' 2' ' ' ASP 0.256 1.0 OUTLIER -60.68 -38.19 84.13 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.909 0.484 . . . . 10.0 112.217 -179.131 . . . . . . . . 4 4 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 mp -57.09 -47.84 80.05 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.581 1.952 . . . . 10.0 113.325 166.823 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.89 -49.69 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.306 0.957 . . . . 10.0 109.458 173.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.4 -46.48 86.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.129 0.972 . . . . 10.0 112.694 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.74 -61.71 2.39 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.094 1.357 . . . . 10.0 111.696 171.452 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.1 -28.24 69.31 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.355 -0.841 . . . . 10.0 112.897 -171.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.15 -16.31 63.86 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 172.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -107.38 -24.21 11.92 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 167.773 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.37 60.46 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.068 1.136 . . . . 10.0 114.068 -177.718 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.1 p -86.92 -4.74 59.21 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.085 1.354 . . . . 10.0 113.668 175.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -153.45 -7.42 0.17 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 116.264 1.95 . . . . 10.0 116.264 -165.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.972 -1.966 . . . . 10.0 114.088 166.549 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.581 ' H3 ' ' CG ' ' A' ' 93' ' ' ASP . . . . . . . . 0 N--CA 1.469 0.895 0 CA-C-O 118.861 -0.966 . . . . 10.0 111.333 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.29 155.61 49.9 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -150.031 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 89.5 t -55.93 -52.87 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 125.25 1.42 . . . . 10.0 110.553 177.042 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -53.38 -53.85 45.13 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.036 1.734 . . . . 10.0 113.691 179.172 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -55.57 -36.43 66.83 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.201 0.6 . . . . 10.0 110.828 173.321 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.53 -53.11 8.91 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.414 -1.074 . . . . 10.0 110.414 -172.088 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.9 pttt -57.54 -46.21 84.14 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.533 1.166 . . . . 10.0 112.466 -179.766 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -67.98 -46.23 71.93 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.601 0.76 . . . . 10.0 112.586 -178.682 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.1 mm -65.7 -35.55 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 118.733 0.697 . . . . 10.0 111.252 175.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -61.22 -53.6 54.81 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.99 0.814 . . . . 10.0 111.293 172.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.5 t -62.92 -11.63 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.341 -0.849 . . . . 10.0 112.81 -178.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -93.38 -59.27 2.06 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.76 1.624 . . . . 10.0 110.908 174.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -95.75 -12.35 25.53 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.738 1.385 . . . . 10.0 114.738 -168.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -123.73 -43.68 2.12 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.932 1.293 . . . . 10.0 111.732 -167.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.52 -7.73 5.11 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 167.093 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -16.44 12.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.766 2.027 . . . . 10.0 113.463 163.305 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.1 m -143.34 -27.48 0.56 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.204 1.802 . . . . 10.0 114.053 179.007 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -107.49 -161.68 0.79 Allowed 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 128.916 2.887 . . . . 10.0 111.309 -178.688 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -151.3 -61.79 0.18 Allowed 'General case' 0 N--CA 1.483 1.2 0 O-C-N 119.639 -1.913 . . . . 10.0 113.765 152.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.416 ' HB ' ' H ' ' A' ' 32' ' ' LEU 0.277 5.1 p 51.51 -48.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 130.219 3.408 . . . . 10.0 117.786 -175.477 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.15 128.26 34.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.122 1.328 . . . . 10.0 108.02 168.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.5 pttt 45.71 30.64 0.85 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.561 1.544 . . . . 10.0 113.842 -169.033 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.885 0 C-N-CA 126.871 2.177 . . . . 10.0 112.515 179.779 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.473 0.718 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.961 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -118.28 164.53 12.84 Favored Glycine 0 CA--C 1.538 1.517 0 N-CA-C 109.373 -1.491 . . . . 10.0 109.373 157.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -70.42 167.25 25.85 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.879 2.386 . . . . 10.0 111.413 -178.691 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -64.89 136.9 57.37 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.027 -1.471 . . . . 10.0 107.027 158.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.416 ' H ' ' HB ' ' A' ' 20' ' ' VAL . 2.8 mm? -79.04 66.93 4.61 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.199 -0.938 . . . . 10.0 109.274 -178.713 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.54 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -52.36 91.29 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 129.276 3.03 . . . . 10.0 111.592 -168.928 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 65.45 -70.26 0.1 OUTLIER Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.286 1.422 . . . . 10.0 111.907 -164.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 65.75 -176.33 0.18 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 127.125 2.17 . . . . 10.0 110.411 -168.574 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 55.83 83.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.476 1.51 . . . . 10.0 113.758 179.277 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.3 -7.05 23.01 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.023 2.725 . . . . 10.0 113.638 -177.436 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.54 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 15.8 ttp180 -86.94 -139.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.099 2.16 . . . . 10.0 114.154 -171.719 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -153.39 162.96 40.75 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.995 2.518 . . . . 10.0 111.073 -177.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 55.0 p -67.21 -59.89 3.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.739 1.216 . . . . 10.0 111.38 178.135 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.04 75.11 0.48 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 125.879 1.704 . . . . 10.0 113.835 -178.427 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -0.34 3.88 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.573 1.694 . . . . 10.0 115.573 175.002 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -52.52 134.45 44.12 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.19 1.396 . . . . 10.0 113.356 -176.689 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -82.45 -107.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.749 2.966 . . . . 10.0 111.053 179.549 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.05 48.38 3.02 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.341 -1.474 . . . . 10.0 112.993 178.508 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -151.7 163.56 38.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.375 1.559 . . . . 10.0 111.997 -177.113 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -154.84 111.37 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.664 1.585 . . . . 10.0 107.03 166.773 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -82.17 -43.22 17.99 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.457 1.503 . . . . 10.0 110.658 -176.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.2 p -156.99 -153.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 129.473 3.109 . . . . 10.0 107.773 177.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -159.86 -171.01 3.08 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.901 1.68 . . . . 10.0 108.226 157.618 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 64.55 -32.14 0.13 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.188 2.195 . . . . 10.0 113.759 -157.772 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -75.37 -42.69 53.4 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 121.975 2.17 . . . . 10.0 113.694 166.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -50.89 -51.22 53.94 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.114 -0.991 . . . . 10.0 111.383 172.294 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -66.13 -16.25 63.8 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.555 1.687 . . . . 10.0 115.555 172.03 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.46 -17.21 59.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.28 1.4 . . . . 10.0 114.224 -179.848 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.82 -44.38 2.05 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.336 -1.813 . . . . 10.0 116.6 170.781 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -31.96 3.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.736 2 C-N-CA 133.915 4.886 . . . . 10.0 122.766 -135.232 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 38.3 m 56.21 104.13 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 128.024 2.53 . . . . 10.0 114.889 -177.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -58.31 140.87 52.61 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 113.559 -1.655 . . . . 10.0 110.94 159.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -175.42 -43.29 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.297 1.439 . . . . 10.0 113.763 -165.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.516 ' CD ' ' HZ1' ' A' ' 99' ' ' LYS 0.253 13.6 pt-20 163.29 -62.36 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 130.0 3.32 . . . . 10.0 111.715 165.558 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -46.22 -45.21 16.82 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.39 1.476 . . . . 10.0 112.538 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.8 p -68.63 -31.43 70.58 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 125.02 1.328 . . . . 10.0 112.535 178.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -75.43 -33.25 60.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.114 1.324 . . . . 10.0 112.591 168.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.7 mtm -57.31 -53.45 58.02 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.48 1.112 . . . . 10.0 109.235 175.26 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -67.74 -41.4 83.46 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 123.917 0.761 . . . . 10.0 110.622 178.608 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.66 -53.7 25.66 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.787 0.662 . . . . 10.0 112.787 -175.867 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -60.27 -42.79 96.14 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.957 1.253 . . . . 10.0 110.934 179.041 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -72.06 -23.84 61.43 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 114.599 1.333 . . . . 10.0 114.599 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 61.65 1.59 Allowed Pre-proline 0 CA--C 1.564 1.491 0 C-N-CA 125.007 1.323 . . . . 10.0 111.088 -167.294 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.63 -62.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.359 2.706 . . . . 10.0 113.835 -162.106 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -61.58 -26.49 68.0 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.177 1.391 . . . . 10.0 113.613 -178.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -71.81 -51.53 22.07 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.015 0.926 . . . . 10.0 110.22 170.854 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -60.76 -47.75 84.9 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.447 0.536 . . . . 10.0 112.447 -177.58 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.85 108.09 9.05 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.319 1.047 . . . . 10.0 109.7 174.947 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.55 153.46 60.28 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 122.03 1.82 . . . . 10.0 110.616 172.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.74 46.43 4.56 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-O 118.956 -0.913 . . . . 10.0 111.922 -170.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -138.44 -39.03 0.53 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 116.051 1.871 . . . . 10.0 116.051 -165.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt 60.27 -65.74 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 -171.279 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.7 ttt 20.46 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 130.059 3.344 . . . . 10.0 113.063 -171.193 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 81' ' ' ILE . 4.0 mp -69.5 74.25 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 126.423 1.889 . . . . 10.0 110.054 -175.432 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -163.51 -40.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.8 1.64 . . . . 10.0 112.605 178.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.57 82.6 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.025 2.53 . . . . 10.0 115.253 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.63 -161.37 16.88 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.942 1.258 . . . . 10.0 111.445 -169.217 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.6 tt -143.33 30.37 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.637 1.175 . . . . 10.0 110.435 170.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttt 69.35 0.59 2.94 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.459 2.304 . . . . 10.0 113.993 -175.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -162.61 173.49 13.86 Favored 'General case' 0 CA--C 1.542 0.649 1 C-N-CA 132.551 4.341 . . . . 10.0 106.979 -176.771 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -77.47 -52.06 9.72 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 155.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 m -43.65 -50.62 7.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.377 1.871 . . . . 10.0 113.054 -155.259 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -65.52 -24.47 67.13 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.652 0.781 . . . . 10.0 112.269 -173.347 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.373 0.0 OUTLIER -76.18 -13.0 60.19 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.328 0.967 . . . . 10.0 113.441 172.498 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -67.31 -52.64 37.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.857 0.863 . . . . 10.0 109.979 161.179 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.581 ' CG ' ' H3 ' ' A' ' 1' ' ' GLY . 4.3 m-20 -57.61 -44.28 85.34 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.52 1.528 . . . . 10.0 112.828 177.752 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.88 90.13 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.991 0.737 . . . . 10.0 112.991 174.303 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.3 mt -62.18 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 119.035 -0.507 . . . . 10.0 110.538 173.583 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.31 75.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.43 0.692 . . . . 10.0 111.916 175.307 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.2 -57.51 12.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.813 1.645 . . . . 10.0 112.946 173.062 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -66.72 -29.12 69.03 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.657 1.117 . . . . 10.0 113.22 -175.019 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.516 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 38.4 ttmt -59.27 -26.95 65.37 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.841 0.856 . . . . 10.0 112.919 168.989 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -85.56 -53.23 5.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 117.821 -1.085 . . . . 10.0 112.009 165.644 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.37 -15.74 39.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.967 1.84 . . . . 10.0 115.967 -171.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.3 t -68.46 -2.78 9.42 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.133 1.161 . . . . 10.0 114.133 165.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -151.2 -23.6 0.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.225 1.81 . . . . 10.0 114.071 -176.218 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.7 2.0 . . . . 10.0 110.921 179.639 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 CA-C-O 118.735 -1.036 . . . . 10.0 110.708 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -133.76 161.38 34.86 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.256 1.206 . . . . 10.0 114.256 -152.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.7 m -68.35 -41.49 83.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 122.709 0.403 . . . . 10.0 111.977 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 mp0 -60.76 -49.26 78.22 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.843 1.257 . . . . 10.0 110.26 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.422 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 8.8 mmpt? -62.71 -14.77 47.99 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.687 1.195 . . . . 10.0 113.095 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -104.79 -45.34 1.41 Allowed Glycine 0 C--N 1.339 0.704 0 CA-C-N 119.703 1.138 . . . . 10.0 112.46 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -34.69 72.3 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.709 1.754 . . . . 10.0 112.443 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -62.19 -28.67 69.83 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.832 1.253 . . . . 10.0 114.259 177.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -98.42 -32.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.139 0.976 . . . . 10.0 110.684 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.464 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 t80 -57.82 -54.32 48.25 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 121.823 -0.548 . . . . 10.0 110.935 169.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.5 t -66.01 -11.62 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -90.25 -56.04 3.37 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.721 1.208 . . . . 10.0 111.325 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -125.59 7.76 7.6 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 116.238 1.94 . . . . 10.0 116.238 -168.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.464 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 33.7 m -110.76 -49.01 3.07 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.295 1.038 . . . . 10.0 110.648 166.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.53 53.07 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.919 1.081 . . . . 10.0 113.919 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -13.77 39.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.827 2.451 . . . . 10.0 113.564 169.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.6 m -141.15 -33.64 0.52 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.229 1.812 . . . . 10.0 112.237 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -120.19 66.6 0.83 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 128.954 2.902 . . . . 10.0 109.922 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -68.19 127.49 33.11 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.356 -1.465 . . . . 10.0 108.178 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.42 -66.39 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 124.632 1.173 . . . . 10.0 110.595 -176.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.53 -31.32 65.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.184 0.902 . . . . 10.0 112.698 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.17 -6.23 59.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.55 1.14 . . . . 10.0 113.785 178.855 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.33 126.5 3.39 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 126.596 2.046 . . . . 10.0 110.871 -163.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -46.15 127.54 9.56 Favored Glycine 0 CA--C 1.538 1.497 0 C-N-CA 125.97 1.747 . . . . 10.0 114.835 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.43 97.76 1.0 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.213 1.805 . . . . 10.0 111.432 169.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.531 ' HB3' ' H ' ' A' ' 31' ' ' ASN . 16.6 p80 -72.29 57.43 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.759 1.623 . . . . 10.0 112.492 170.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.9 pttt -83.14 -17.58 42.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.761 1.393 . . . . 10.0 114.761 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.4 m -154.3 -10.42 0.14 Allowed 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.056 -1.027 . . . . 10.0 113.398 170.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.66 167.35 24.83 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 157.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.02 127.9 16.8 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.854 2.369 . . . . 10.0 110.805 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.531 ' H ' ' HB3' ' A' ' 26' ' ' HIS . 0.3 OUTLIER -63.99 127.61 32.19 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.224 -0.923 . . . . 10.0 110.45 -178.899 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.7 81.5 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.858 1.263 . . . . 10.0 111.862 -170.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.68 73.14 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.111 2.164 . . . . 10.0 109.962 163.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.78 -63.08 0.32 Allowed Glycine 0 CA--C 1.535 1.312 0 C-N-CA 127.718 2.58 . . . . 10.0 114.065 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 68.29 -48.6 0.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.449 2.7 . . . . 10.0 116.022 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -63.67 113.44 3.36 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.595 1.089 . . . . 10.0 111.095 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.48 0.0 82.37 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.954 1.264 . . . . 10.0 113.947 -175.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.8 mtp85 -86.89 -127.93 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.901 1.281 . . . . 10.0 110.802 172.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -154.35 173.41 16.23 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.188 1.795 . . . . 10.0 110.99 -172.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 t -95.8 -48.16 5.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.967 0.907 . . . . 10.0 113.344 -174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.05 61.66 2.99 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.528 1.537 . . . . 10.0 111.609 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -130.15 -18.96 3.23 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.088 1.755 . . . . 10.0 113.347 -161.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.32 151.74 86.5 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 124.464 1.105 . . . . 10.0 112.572 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -76.01 -160.19 0.11 Allowed 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 124.277 3.318 . . . . 10.0 110.839 167.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.23 86.96 0.01 OUTLIER Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.715 2.103 . . . . 10.0 115.327 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -144.05 -179.43 6.49 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.329 2.252 . . . . 10.0 109.559 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.6 m -156.86 142.9 17.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 119.741 -1.849 . . . . 10.0 109.774 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.55 -85.72 0.06 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.886 0.874 . . . . 10.0 112.806 -163.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 t -144.93 173.85 11.52 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.639 2.776 . . . . 10.0 108.751 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.05 -37.33 58.42 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.953 -1.092 . . . . 10.0 112.322 155.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.1 -61.82 1.99 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.022 1.329 . . . . 10.0 112.776 -160.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -51.71 -61.82 2.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.963 0.905 . . . . 10.0 111.906 -171.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -56.08 26.79 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.418 1.087 . . . . 10.0 111.847 -176.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -44.2 82.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.176 -0.916 . . . . 10.0 111.737 -171.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.59 -45.25 38.7 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.171 -0.919 . . . . 10.0 111.708 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 55.37 -179.24 0.33 Allowed Glycine 0 CA--C 1.54 1.621 0 N-CA-C 116.696 1.438 . . . . 10.0 116.696 -176.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.66 -6.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 128.328 2.651 . . . . 10.0 113.701 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.0 m 55.84 115.95 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.846 2.059 . . . . 10.0 113.038 -159.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -73.09 126.3 29.67 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.295 -0.878 . . . . 10.0 111.658 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -165.34 176.03 8.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.272 2.229 . . . . 10.0 110.184 -174.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.32 -30.06 64.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.248 1.419 . . . . 10.0 114.33 -176.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -71.96 -71.65 0.27 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.853 0.861 . . . . 10.0 110.746 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.5 p -59.61 -38.15 80.49 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 125.88 1.672 . . . . 10.0 112.844 -165.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.28 -29.44 60.11 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.289 0.949 . . . . 10.0 113.134 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 ttm -69.6 -48.75 59.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 171.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -57.29 -45.0 84.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.275 1.43 . . . . 10.0 110.546 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -61.48 -60.04 4.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.619 1.568 . . . . 10.0 112.945 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -56.63 -32.23 65.12 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.783 1.629 . . . . 10.0 114.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.21 -24.61 63.13 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.909 1.448 . . . . 10.0 114.909 174.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -163.3 91.71 1.17 Allowed Pre-proline 0 CA--C 1.552 1.035 0 CA-C-N 119.759 1.163 . . . . 10.0 112.602 162.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.98 -37.99 2.48 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.406 2.071 . . . . 10.0 112.544 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -59.06 -43.12 91.69 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.878 1.671 . . . . 10.0 112.444 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -75.0 -41.06 60.24 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 118.982 -0.532 . . . . 10.0 111.434 175.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -69.04 -36.72 78.03 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.821 1.415 . . . . 10.0 114.821 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -131.18 127.82 21.99 Favored Pre-proline 0 N--CA 1.475 0.788 0 CA-C-N 119.169 0.895 . . . . 10.0 111.035 172.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.15 93.8 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.912 3.075 . . . . 10.0 113.315 -153.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 110.97 0.0 28.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.574 1.083 . . . . 10.0 114.299 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.5 m -60.15 106.58 0.53 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.68 1.24 . . . . 10.0 111.206 172.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -64.36 -56.67 12.8 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.211 -0.9 . . . . 10.0 112.157 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.0 ttt 25.31 84.2 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.814 2.445 . . . . 10.0 114.115 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 30.8 mt -73.57 77.33 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.937 1.295 . . . . 10.0 110.829 -172.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -163.34 -45.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.15 1.78 . . . . 10.0 111.62 170.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.58 0.96 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 120.743 3.608 . . . . 10.0 120.743 172.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.72 170.71 40.65 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 125.516 1.531 . . . . 10.0 111.176 169.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -143.18 63.12 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 118.809 1.305 . . . . 10.0 112.861 -164.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 62.29 -56.87 0.14 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 128.22 2.608 . . . . 10.0 116.096 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -163.47 156.25 18.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.6 2.36 . . . . 10.0 109.096 -169.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -7.7 11.79 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 10.0 115.301 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -54.1 8.8 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.446 1.499 . . . . 10.0 110.751 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -54.28 -35.3 62.42 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.306 1.042 . . . . 10.0 110.95 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -56.8 -65.19 0.66 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.583 1.953 . . . . 10.0 112.107 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -31.56 72.47 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.997 0.74 . . . . 10.0 112.997 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -57.55 -47.42 82.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.692 0.797 . . . . 10.0 110.61 170.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.82 -46.43 84.7 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 175.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.1 mm -56.48 -52.53 51.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.82 60.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 117.64 -1.171 . . . . 10.0 113.669 -174.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.4 -64.87 0.76 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.374 1.869 . . . . 10.0 110.805 162.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.6 mt -60.17 -30.28 69.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.278 0.631 . . . . 10.0 112.684 -174.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -59.3 -21.93 60.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.872 1.064 . . . . 10.0 113.872 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -79.27 -45.19 20.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.694 -1.146 . . . . 10.0 110.809 168.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.19 1.28 0.19 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.304 1.594 . . . . 10.0 115.304 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.6 p -110.37 11.84 23.21 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.859 1.663 . . . . 10.0 114.348 168.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -153.57 -34.59 0.11 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.534 1.061 . . . . 10.0 113.815 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 . . . . . 0 C--O 1.259 1.563 0 C-N-CA 125.161 1.385 . . . . 10.0 110.9 149.669 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.896 0 CA-C-O 118.416 -1.213 . . . . 10.0 111.007 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -109.21 145.51 35.74 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.905 0.852 . . . . 10.0 112.467 -167.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.12 -41.43 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 118.413 -0.803 . . . . 10.0 112.005 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -51.79 -57.03 10.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.911 1.284 . . . . 10.0 112.611 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -57.06 -25.5 58.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.006 1.323 . . . . 10.0 111.722 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -86.94 -50.37 3.73 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.406 1.479 . . . . 10.0 111.841 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.5 pttp -63.13 -43.21 99.01 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.76 1.28 . . . . 10.0 111.57 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -40.83 97.7 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.054 -0.974 . . . . 10.0 111.728 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.85 -25.29 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 119.384 0.993 . . . . 10.0 112.774 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -55.96 -50.75 69.94 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.249 -0.907 . . . . 10.0 109.681 163.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.04 29.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 N-CA-C 113.415 0.894 . . . . 10.0 113.415 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -36.57 5.36 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 119.265 -2.147 . . . . 10.0 112.272 164.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.99 -55.59 1.37 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.631 0.772 . . . . 10.0 112.921 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -52.15 -49.49 63.66 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 125.256 1.422 . . . . 10.0 112.802 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.7 -22.87 62.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.925 1.083 . . . . 10.0 113.925 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -16.16 51.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.92 0.888 . . . . 10.0 112.356 173.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 82.1 m -141.34 0.51 1.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.864 1.266 . . . . 10.0 114.228 -174.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -150.47 12.17 0.71 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.593 1.331 . . . . 10.0 114.593 -172.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 t -42.76 104.9 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.7 1.741 . . . . 10.0 115.7 -165.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.8 p -142.29 -8.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 127.339 2.256 . . . . 10.0 112.559 -171.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.73 -18.82 13.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.124 1.369 . . . . 10.0 112.033 165.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -152.76 145.98 24.72 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.395 1.478 . . . . 10.0 110.981 155.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 -59.1 2.27 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.354 1.454 . . . . 10.0 115.559 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.87 120.69 1.79 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 124.527 1.06 . . . . 10.0 112.231 -169.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.22 150.3 18.21 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 128.244 2.618 . . . . 10.0 108.841 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -81.57 -96.81 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.571 1.148 . . . . 10.0 111.548 -175.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 mttm 56.33 106.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 128.506 2.723 . . . . 10.0 112.73 -169.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.2 m 57.85 -31.42 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.612 2.365 . . . . 10.0 116.676 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.57 168.86 14.98 Favored Glycine 0 CA--C 1.543 1.807 0 CA-C-N 120.582 1.537 . . . . 10.0 112.918 171.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HA ' ' CD2' ' A' ' 46' ' ' PHE . 20.9 Cg_endo -71.55 -8.09 22.54 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 124.691 3.594 . . . . 10.0 118.61 -167.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.57 142.16 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.741 1.616 . . . . 10.0 113.87 -154.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -85.51 70.39 10.76 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.052 -1.03 . . . . 10.0 110.157 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.27 114.53 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.316 1.446 . . . . 10.0 110.17 165.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 9.14 76.36 0.01 OUTLIER Glycine 0 N--CA 1.476 1.308 0 C-N-CA 129.044 3.212 . . . . 10.0 115.9 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -30.6 65.3 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 116.189 1.922 . . . . 10.0 116.189 -156.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -85.87 93.67 8.97 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.965 0.802 . . . . 10.0 111.607 -159.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.08 -13.91 6.31 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 127.051 2.262 . . . . 10.0 114.282 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -85.81 157.98 20.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.733 1.266 . . . . 10.0 113.416 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -77.01 169.76 17.75 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.659 1.184 . . . . 10.0 112.023 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.2 t -50.91 155.54 1.17 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.065 2.146 . . . . 10.0 115.927 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 59.11 31.06 68.11 Favored Glycine 0 CA--C 1.539 1.546 0 N-CA-C 118.458 2.143 . . . . 10.0 118.458 155.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -83.59 7.0 18.62 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 120.241 2.021 . . . . 10.0 115.363 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 133.91 93.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.623 1.102 . . . . 10.0 112.72 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.12 87.38 0.73 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.646 2.23 . . . . 10.0 113.041 -172.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.13 -1.7 88.5 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.947 1.736 . . . . 10.0 115.823 167.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.428 ' CD2' ' HA ' ' A' ' 30' ' ' PRO . 1.0 OUTLIER -66.39 137.08 56.62 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.754 1.277 . . . . 10.0 112.067 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 m -72.61 83.08 1.13 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.716 1.607 . . . . 10.0 112.652 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.28 175.33 9.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.639 1.176 . . . . 10.0 112.917 168.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.1 p -76.68 -175.36 3.36 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.695 1.598 . . . . 10.0 113.572 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -66.79 177.09 1.75 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.208 1.403 . . . . 10.0 113.23 152.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.67 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 129.352 3.061 . . . . 10.0 116.029 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.543 HD21 ' CGD' ' A' ' 105' ' ' HEC . 8.6 t30 -47.61 -59.93 2.91 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.891 1.678 . . . . 10.0 112.286 -170.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -27.0 68.97 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.545 -0.722 . . . . 10.0 112.482 -176.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -26.8 63.86 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 117.209 2.3 . . . . 10.0 117.209 171.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -163.29 -1.31 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 116.648 2.092 . . . . 10.0 116.648 -155.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -67.85 163.34 47.47 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.63 1.586 . . . . 10.0 114.107 -177.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -66.31 173.89 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.89 2.476 . . . . 10.0 114.206 -176.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 m -69.57 124.33 23.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.024 0.93 . . . . 10.0 110.232 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -75.38 124.64 27.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.578 0.751 . . . . 10.0 111.716 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.8 pttt -171.3 -176.73 1.95 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.562 2.345 . . . . 10.0 109.5 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.498 ' CD ' ' HZ2' ' A' ' 99' ' ' LYS . 0.9 OUTLIER -44.33 -55.07 5.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.901 0.88 . . . . 10.0 112.299 174.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.21 12.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.948 2.499 . . . . 10.0 115.783 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 63.5 p -157.67 -34.8 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.246 1.018 . . . . 10.0 111.356 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -33.27 60.69 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.807 1.185 . . . . 10.0 112.761 169.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 70.3 mtm -66.28 -48.15 71.35 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.979 1.263 . . . . 10.0 110.521 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -63.89 -37.79 88.71 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 122.652 0.381 . . . . 10.0 110.397 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -65.01 -60.63 2.83 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-O 119.035 -0.507 . . . . 10.0 111.927 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -29.92 70.31 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 120.196 1.362 . . . . 10.0 112.444 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -69.08 -31.24 69.84 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 170.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.84 76.79 1.67 Allowed Pre-proline 0 CA--C 1.553 1.078 0 CA-C-N 120.035 1.289 . . . . 10.0 113.163 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.01 -44.23 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.928 1.752 . . . . 10.0 111.942 -159.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -68.03 -30.65 69.93 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 126.427 1.891 . . . . 10.0 112.7 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -76.26 -40.24 52.36 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.737 1.215 . . . . 10.0 112.352 168.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -63.97 -45.88 87.1 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.748 0.704 . . . . 10.0 112.45 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.99 129.39 10.52 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.796 1.638 . . . . 10.0 110.414 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.62 179.42 4.7 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.806 2.337 . . . . 10.0 112.656 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.2 -33.87 1.1 Allowed Glycine 0 CA--C 1.529 0.943 0 C-N-CA 126.216 1.865 . . . . 10.0 114.156 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 90.3 m -60.56 83.26 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.997 1.719 . . . . 10.0 113.957 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.22 31.96 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.477 2.711 . . . . 10.0 114.123 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.7 ttt -64.39 108.78 1.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.058 1.743 . . . . 10.0 111.219 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 mt -76.5 67.33 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.856 1.262 . . . . 10.0 110.481 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -163.43 -35.9 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.693 1.368 . . . . 10.0 114.693 172.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.22 -3.96 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 121.154 3.761 . . . . 10.0 121.154 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.83 -147.72 5.08 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-N 120.868 1.667 . . . . 10.0 112.148 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tt -144.48 171.86 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.937 0.895 . . . . 10.0 108.89 158.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -75.01 -7.31 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.618 1.34 . . . . 10.0 114.618 -160.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.59 -67.37 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.882 1.273 . . . . 10.0 110.666 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.38 -53.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 127.577 2.351 . . . . 10.0 112.634 162.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.7 m -50.92 -33.62 25.07 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.357 1.863 . . . . 10.0 112.118 -168.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -45.15 -50.09 11.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.254 1.422 . . . . 10.0 112.202 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.353 0.0 OUTLIER -77.76 -10.84 59.75 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.112 1.523 . . . . 10.0 115.112 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -75.02 -40.72 60.36 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.163 0.892 . . . . 10.0 110.488 162.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.22 -40.28 78.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.417 1.087 . . . . 10.0 112.092 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 15.9 tp -57.84 -46.23 85.08 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.579 1.552 . . . . 10.0 113.122 178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 mm -59.07 -46.42 91.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 C-N-CA 124.176 0.99 . . . . 10.0 109.786 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -43.36 98.75 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.146 0.43 . . . . 10.0 111.931 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.6 -56.64 19.6 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.824 0.85 . . . . 10.0 111.974 170.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.15 -26.55 68.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.778 1.172 . . . . 10.0 112.955 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.498 ' HZ2' ' CD ' ' A' ' 61' ' ' GLU . 32.1 tptt -60.01 -12.2 7.54 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.402 1.481 . . . . 10.0 113.382 167.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -131.62 36.04 3.77 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.206 3.002 . . . . 10.0 111.979 166.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.72 30.69 4.34 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.4 1.48 . . . . 10.0 110.052 154.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -142.36 7.73 1.76 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.895 2.078 . . . . 10.0 115.112 -174.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -153.05 -73.24 0.14 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.454 2.302 . . . . 10.0 108.242 177.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.258 1.529 0 CA-C-O 117.133 -1.413 . . . . 10.0 109.083 124.222 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.543 ' CGD' HD21 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.96 0 CA-C-O 119.112 -0.826 . . . . 10.0 111.407 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -93.99 -173.16 3.04 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.399 1.88 . . . . 10.0 110.853 176.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.0 t -78.78 -32.9 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 120.312 -1.492 . . . . 10.0 111.166 143.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -36.08 79.1 Favored 'General case' 0 CA--C 1.514 -0.425 0 C-N-CA 128.063 2.545 . . . . 10.0 114.224 -159.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -73.36 -25.47 60.61 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.44 -54.5 5.51 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 126.167 1.842 . . . . 10.0 110.289 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -23.39 67.4 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.485 1.291 . . . . 10.0 114.485 178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -76.49 -53.49 8.03 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 120.143 1.338 . . . . 10.0 113.414 164.283 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.32 -31.33 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.438 1.017 . . . . 10.0 112.555 -170.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.56 -51.31 69.06 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.175 0.443 . . . . 10.0 109.999 172.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.2 -9.1 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 112.868 0.692 . . . . 10.0 112.868 -177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -96.11 -47.68 5.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.374 1.47 . . . . 10.0 111.562 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -119.62 -8.53 9.94 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.428 1.64 . . . . 10.0 115.428 -170.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 34.5 m -113.92 -45.16 3.1 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.813 1.245 . . . . 10.0 111.325 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.21 -25.04 61.13 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 176.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.05 -14.39 0.41 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.415 2.686 . . . . 10.0 114.096 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -141.23 -34.7 0.48 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.609 1.564 . . . . 10.0 112.053 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -103.58 -9.68 19.05 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.949 1.463 . . . . 10.0 114.949 -173.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.419 HG21 ' H ' ' A' ' 20' ' ' VAL 0.359 6.8 t 38.58 -88.93 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.305 2.642 . . . . 10.0 115.694 -166.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.419 ' H ' HG21 ' A' ' 19' ' ' THR 0.3 8.7 p 37.48 48.51 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 128.965 2.906 . . . . 10.0 115.986 174.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.44 -41.11 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.274 1.03 . . . . 10.0 112.784 170.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -154.14 -40.99 0.09 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 130.431 3.492 . . . . 10.0 110.786 -173.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.45 136.04 13.24 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 127.064 2.269 . . . . 10.0 112.302 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.19 121.01 7.06 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.682 1.611 . . . . 10.0 112.173 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -164.6 171.25 14.71 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.266 2.626 . . . . 10.0 108.068 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -154.47 115.46 4.02 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.407 1.483 . . . . 10.0 108.826 -174.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.46 124.3 13.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.089 0.556 . . . . 10.0 110.047 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.9 m 56.26 -19.77 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.763 2.025 . . . . 10.0 115.66 -166.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -133.72 163.82 24.42 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.564 2.031 . . . . 10.0 111.754 162.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.72 161.56 21.6 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.261 2.641 . . . . 10.0 112.075 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.534 HD22 ' CD2' ' A' ' 33' ' ' HIS . 8.9 p-10 -65.29 11.25 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 130.267 3.427 . . . . 10.0 115.944 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt 50.52 -33.25 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.952 1 C-N-CA 132.075 4.15 . . . . 10.0 118.181 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.534 ' CD2' HD22 ' A' ' 31' ' ' ASN 0.276 0.0 OUTLIER 34.5 72.58 0.09 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.631 3.172 . . . . 10.0 114.227 178.789 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.92 -34.49 0.74 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 126.288 1.899 . . . . 10.0 114.667 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tp 60.51 -68.08 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.814 3.246 . . . . 10.0 116.387 170.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -65.67 114.51 5.03 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.645 1.578 . . . . 10.0 110.82 -171.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.68 1.83 88.94 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 118.654 -1.081 . . . . 10.0 114.484 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.482 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.6 OUTLIER -78.81 -96.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.887 1.343 . . . . 10.0 108.469 169.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -156.64 175.18 14.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.752 2.421 . . . . 10.0 109.781 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.7 m -109.09 95.37 5.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.871 -1.9 . . . . 10.0 105.871 153.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.27 -66.3 0.09 OUTLIER Glycine 0 CA--C 1.528 0.858 0 CA-C-O 122.022 0.79 . . . . 10.0 113.069 -163.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -64.77 133.91 53.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.679 1.992 . . . . 10.0 113.514 -172.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.66 150.76 10.48 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 128.47 2.708 . . . . 10.0 107.317 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.57 66.27 8.55 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.734 2.956 . . . . 10.0 111.817 -176.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.86 71.59 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.295 0.95 . . . . 10.0 115.219 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.11 119.59 10.46 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.08 1.352 . . . . 10.0 111.204 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.0 m -70.92 82.98 0.66 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.291 1.837 . . . . 10.0 113.174 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.541 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -86.17 -173.25 4.47 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.795 1.638 . . . . 10.0 113.896 170.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.3 t -62.57 172.49 1.57 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 126.188 1.795 . . . . 10.0 111.581 168.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -75.47 -80.44 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 120.417 -1.427 . . . . 10.0 111.511 154.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 69.42 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 131.365 3.866 . . . . 10.0 116.498 -165.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -161.68 -70.89 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.363 2.265 . . . . 10.0 107.601 169.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.541 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -55.16 -37.44 66.99 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.11 2.564 . . . . 10.0 111.197 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.74 -37.6 84.82 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.54 1.136 . . . . 10.0 113.192 176.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -76.91 -50.09 14.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.076 0.853 . . . . 10.0 112.011 170.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.34 82.16 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.896 1.236 . . . . 10.0 113.394 -175.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.5 pp -66.23 -16.95 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.067 -1.255 . . . . 10.0 113.618 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.446 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 24.3 m 55.77 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 129.378 3.071 . . . . 10.0 113.393 -169.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.569 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 51.2 m95 -77.18 146.78 36.84 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 120.887 -1.133 . . . . 10.0 111.421 168.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 58' ' ' THR . 7.2 ptpt -163.64 -51.46 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.351 1.46 . . . . 10.0 110.939 -170.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 171.87 -55.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 130.338 3.455 . . . . 10.0 109.44 164.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -44.72 -54.9 5.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.148 2.179 . . . . 10.0 112.48 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 66.9 p -65.52 -28.25 69.04 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 125.213 1.405 . . . . 10.0 113.209 -173.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -28.5 59.99 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.375 1.07 . . . . 10.0 112.337 173.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.4 mtm -69.88 -47.5 62.37 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-O 118.738 -0.649 . . . . 10.0 110.793 172.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -61.83 -43.2 99.33 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.153 0.502 . . . . 10.0 110.438 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -57.97 -67.41 0.34 Allowed 'General case' 0 C--O 1.221 -0.441 0 CA-C-O 117.553 -1.213 . . . . 10.0 111.924 176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 mt -65.87 -19.55 65.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 121.439 1.927 . . . . 10.0 114.816 -173.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -73.75 -24.7 59.91 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.813 1.188 . . . . 10.0 113.881 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.78 64.84 1.55 Allowed Pre-proline 0 CA--C 1.559 1.311 0 CA-C-N 120.124 1.329 . . . . 10.0 112.999 -177.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -72.32 -46.58 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.183 1.922 . . . . 10.0 113.014 -159.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -26.47 68.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.552 1.141 . . . . 10.0 112.697 176.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -76.16 -48.07 21.87 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.728 0.811 . . . . 10.0 111.291 169.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.65 -38.1 88.38 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.561 0.948 . . . . 10.0 113.561 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 pt -142.81 105.58 5.33 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.819 1.248 . . . . 10.0 109.644 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.16 -24.58 44.29 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.484 2.789 . . . . 10.0 115.321 -155.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.33 -9.53 81.7 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.586 -1.119 . . . . 10.0 114.385 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.1 m -76.88 75.75 3.48 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.916 1.858 . . . . 10.0 112.442 -172.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -68.97 27.11 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.714 2.006 . . . . 10.0 114.609 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.8 ttp -50.67 117.68 2.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.31 2.244 . . . . 10.0 111.83 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.0 mt -76.48 68.3 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.511 1.524 . . . . 10.0 109.638 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -163.85 -32.28 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.466 1.506 . . . . 10.0 113.533 174.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.7 -24.06 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 120.145 3.387 . . . . 10.0 120.145 -173.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 173.02 167.2 32.6 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 122.131 2.242 . . . . 10.0 113.844 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 tt -93.32 160.71 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.868 0.867 . . . . 10.0 111.909 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.07 -31.49 65.26 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 116.024 1.861 . . . . 10.0 116.024 -167.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -164.34 148.61 9.68 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.724 1.61 . . . . 10.0 109.766 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -20.62 65.28 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.326 1.232 . . . . 10.0 114.326 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.0 m -59.26 -44.25 92.42 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.08 -1.013 . . . . 10.0 111.254 171.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.03 -35.83 82.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.297 1.439 . . . . 10.0 111.045 177.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -60.08 -47.94 83.78 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.316 1.446 . . . . 10.0 111.239 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -59.31 -51.32 70.43 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.626 0.77 . . . . 10.0 111.485 170.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -43.71 81.39 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.826 1.65 . . . . 10.0 112.683 -174.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.6 -37.88 73.97 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.35 -48.75 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 118.639 0.654 . . . . 10.0 109.441 173.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.04 -49.78 76.58 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.369 0.668 . . . . 10.0 112.038 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.05 -59.16 5.14 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.091 0.956 . . . . 10.0 111.91 172.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.45 -35.62 79.86 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.406 1.003 . . . . 10.0 112.201 -176.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.74 -15.93 63.3 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.462 1.028 . . . . 10.0 112.976 177.129 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -109.84 20.56 17.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.059 1.343 . . . . 10.0 114.248 165.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.56 -1.18 14.15 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.596 1.558 . . . . 10.0 112.561 164.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.47 -4.36 57.33 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.798 -1.189 . . . . 10.0 113.053 173.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -154.9 3.34 0.21 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.104 1.362 . . . . 10.0 113.973 -159.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 127.755 2.422 . . . . 10.0 107.809 -173.232 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.569 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.478 ' H2 ' ' CG ' ' A' ' 93' ' ' ASP . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 110.623 -0.991 . . . . 10.0 110.623 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -136.76 135.94 38.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.537 1.535 . . . . 10.0 109.198 -161.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.9 t -54.33 -49.95 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.94 0.896 . . . . 10.0 111.08 -172.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.96 -56.31 19.0 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.674 1.59 . . . . 10.0 112.976 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -61.01 -24.87 66.49 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 112.875 0.695 . . . . 10.0 112.875 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.48 -50.58 6.53 Favored Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.042 -1.223 . . . . 10.0 110.042 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -63.32 -43.16 98.59 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 118.911 1.355 . . . . 10.0 113.274 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -39.21 92.39 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.134 0.879 . . . . 10.0 112.75 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -79.29 -36.07 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.792 0.724 . . . . 10.0 111.719 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -56.21 -48.85 75.63 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.997 0.919 . . . . 10.0 110.683 171.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.61 -15.58 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 113.609 0.966 . . . . 10.0 113.609 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -96.08 -33.72 11.99 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 123.946 0.898 . . . . 10.0 113.42 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.9 1.84 2.8 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 116.109 1.892 . . . . 10.0 116.109 -172.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -122.12 -49.2 2.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.013 1.725 . . . . 10.0 110.851 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.72 66.71 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.545 0.943 . . . . 10.0 113.545 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -46.07 -47.92 17.05 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.911 1.684 . . . . 10.0 112.057 171.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 98.5 m -89.22 -44.39 10.31 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 10.0 113.408 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.415 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 88.9 m-70 -105.96 -10.02 16.8 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.607 2.077 . . . . 10.0 116.607 -162.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.308 11.1 t 37.42 -82.17 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 127.699 2.4 . . . . 10.0 116.732 -164.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.267 7.5 p 46.25 -51.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 131.35 3.86 . . . . 10.0 116.055 -161.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -20.11 0.1 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 131.487 3.915 . . . . 10.0 117.642 -168.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.4 pttm -152.49 22.57 0.62 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.844 1.658 . . . . 10.0 111.546 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -163.09 54.58 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 121.891 0.717 . . . . 10.0 111.862 -165.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.2 -123.67 5.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.467 1.984 . . . . 10.0 110.6 -176.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -160.38 165.09 31.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.421 1.088 . . . . 10.0 112.529 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -78.96 129.63 34.69 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.118 2.567 . . . . 10.0 112.011 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.72 108.92 5.01 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.422 1.089 . . . . 10.0 108.944 173.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 m 56.62 -29.03 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 127.274 2.23 . . . . 10.0 115.46 -163.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.03 136.3 12.92 Favored Glycine 0 CA--C 1.542 1.769 0 CA-C-N 120.748 1.613 . . . . 10.0 111.65 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 9.6 Cg_endo -59.66 1.57 0.39 Allowed 'Trans proline' 0 C--N 1.353 0.787 1 C-N-CA 127.2 5.266 . . . . 10.0 118.411 -173.218 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER 63.11 143.02 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.916 2.486 . . . . 10.0 114.12 -161.119 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.29 65.41 9.19 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.287 1.042 . . . . 10.0 110.913 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.81 163.58 1.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.048 1.339 . . . . 10.0 111.446 158.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.8 85.87 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.933 1.73 . . . . 10.0 116.267 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.18 -168.14 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.222 2.609 . . . . 10.0 113.215 169.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 55.02 35.28 24.33 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.819 2.448 . . . . 10.0 114.622 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 166.84 -19.64 0.09 OUTLIER Glycine 0 CA--C 1.531 1.075 0 N-CA-C 115.271 0.869 . . . . 10.0 115.271 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -74.58 -145.23 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.909 1.284 . . . . 10.0 110.994 164.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -151.85 -179.74 7.73 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.636 1.974 . . . . 10.0 109.072 171.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.2 p -59.8 158.32 10.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.448 1.118 . . . . 10.0 112.971 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.0 -8.24 78.75 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 116.96 1.544 . . . . 10.0 116.96 163.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -71.13 -7.12 44.4 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.396 1.998 . . . . 10.0 116.396 -167.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.45 134.87 96.13 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.445 1.475 . . . . 10.0 111.275 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -76.77 155.67 34.97 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.014 1.809 . . . . 10.0 111.774 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 21.99 68.01 0.02 OUTLIER Glycine 0 CA--C 1.536 1.363 0 C-N-CA 128.765 3.079 . . . . 10.0 116.67 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -147.62 -42.58 0.17 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.673 0.99 . . . . 10.0 113.673 -172.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 m 60.02 83.76 0.13 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.159 2.184 . . . . 10.0 114.049 170.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -115.46 115.5 26.64 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 126.063 1.745 . . . . 10.0 112.86 -172.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.5 t 50.18 175.87 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.187 2.195 . . . . 10.0 115.119 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -78.49 -69.66 0.55 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.0 1.72 . . . . 10.0 112.316 161.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.36 -30.31 68.29 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.668 1.587 . . . . 10.0 114.21 -157.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.98 -63.42 1.16 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 119.008 0.822 . . . . 10.0 110.668 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -52.13 -43.16 63.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 119.082 -0.485 . . . . 10.0 110.432 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.67 -32.04 73.38 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.622 2.082 . . . . 10.0 116.622 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -54.43 -35.34 62.85 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.816 1.644 . . . . 10.0 113.673 -170.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.26 -9.49 47.67 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.56 1.552 . . . . 10.0 115.646 168.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.8 pp -63.0 159.93 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 126.336 1.854 . . . . 10.0 112.619 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -9.6 58.5 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.415 1.486 . . . . 10.0 114.936 -169.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.5 m95 45.28 97.42 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.556 2.742 . . . . 10.0 114.012 -162.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -161.59 -178.83 6.84 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.168 1.387 . . . . 10.0 109.917 -169.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -61.21 -29.62 69.93 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.667 1.729 . . . . 10.0 115.667 -155.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.49 -51.15 31.01 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 122.299 2.318 . . . . 10.0 111.484 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.4 p -72.32 -40.53 67.4 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.274 1.429 . . . . 10.0 113.153 -174.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.26 -30.24 64.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.977 0.911 . . . . 10.0 111.88 174.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 36.8 ttm -67.81 -48.7 65.5 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.493 -0.765 . . . . 10.0 109.565 169.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -54.3 -44.75 72.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.876 0.762 . . . . 10.0 110.916 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -69.39 -55.95 8.87 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.401 -0.809 . . . . 10.0 112.659 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.51 -11.03 60.49 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.814 1.643 . . . . 10.0 114.379 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -84.72 -29.46 25.53 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 120.507 1.503 . . . . 10.0 112.854 163.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.5 75.61 1.81 Allowed Pre-proline 0 CA--C 1.558 1.267 0 CA-C-N 119.106 0.866 . . . . 10.0 113.002 -172.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -71.3 -56.77 0.11 Allowed 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.486 2.124 . . . . 10.0 112.824 -163.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -65.02 -17.54 64.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.028 1.331 . . . . 10.0 113.905 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -76.34 -49.5 16.7 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.265 1.426 . . . . 10.0 111.586 165.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -62.93 -34.35 77.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.421 0.897 . . . . 10.0 113.421 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.84 125.45 7.46 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.393 1.477 . . . . 10.0 110.66 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.85 169.01 21.34 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.636 2.224 . . . . 10.0 112.657 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.31 -104.46 1.28 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.458 -1.457 . . . . 10.0 109.458 -166.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.4 m 59.93 -39.67 0.09 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 129.217 3.007 . . . . 10.0 118.364 165.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 59.97 -57.59 0.07 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 128.237 2.615 . . . . 10.0 116.311 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt -3.7 87.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 129.824 3.25 . . . . 10.0 113.772 -168.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.416 ' H ' HD11 ' A' ' 81' ' ' ILE . 3.9 mp -77.23 70.4 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.82 1.648 . . . . 10.0 109.884 -166.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -163.01 -27.08 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.852 1.661 . . . . 10.0 113.02 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.86 -12.57 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 121.136 3.754 . . . . 10.0 121.136 172.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.34 -142.73 3.46 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 120.688 1.585 . . . . 10.0 111.808 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -144.71 165.12 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.805 0.842 . . . . 10.0 109.912 159.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -67.82 -21.33 65.22 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.852 1.797 . . . . 10.0 115.852 -167.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -163.07 140.68 7.84 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.416 1.486 . . . . 10.0 109.703 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -54.94 -41.79 71.49 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 -159.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -46.08 64.1 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.144 0.977 . . . . 10.0 111.159 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -58.03 -25.8 61.62 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.033 0.933 . . . . 10.0 112.305 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -29.05 59.85 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.853 0.861 . . . . 10.0 113.317 174.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -72.17 -47.19 52.66 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.592 1.157 . . . . 10.0 110.24 169.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.478 ' CG ' ' H2 ' ' A' ' 1' ' ' GLY . 3.2 m-20 -58.35 -39.41 79.44 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.647 1.179 . . . . 10.0 112.332 174.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.56 -48.45 79.31 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 168.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.7 mm -60.43 -45.14 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.078 0.854 . . . . 10.0 109.823 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.74 80.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.097 0.559 . . . . 10.0 112.453 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.7 -60.38 3.93 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.208 1.003 . . . . 10.0 112.075 174.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.27 -24.52 65.79 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -171.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -57.72 -55.02 40.25 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.884 0.765 . . . . 10.0 111.208 165.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -67.28 -33.19 74.78 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 117.853 -1.07 . . . . 10.0 113.505 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.12 -12.36 2.14 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.619 1.341 . . . . 10.0 114.619 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 p -76.63 -11.16 59.81 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.191 1.397 . . . . 10.0 114.209 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.26 9.45 0.42 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.048 1.339 . . . . 10.0 114.559 -168.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.973 2.909 . . . . 10.0 109.138 -174.054 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.427 0 CA-C-O 119.324 -0.709 . . . . 10.0 112.753 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.39 105.26 9.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 117.893 0.846 . . . . 10.0 109.671 -155.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.9 t -46.4 -48.98 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.57 1.548 . . . . 10.0 111.819 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -66.21 -34.7 78.62 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.096 1.358 . . . . 10.0 113.207 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -73.21 -31.64 64.29 Favored 'General case' 0 C--O 1.23 0.063 0 C-N-CA 123.803 0.841 . . . . 10.0 111.754 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.54 -42.14 56.06 Favored Glycine 0 C--O 1.226 -0.349 0 N-CA-C 109.588 -1.405 . . . . 10.0 109.588 -171.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -55.67 -48.16 75.51 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 171.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.65 66.83 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.685 0.994 . . . . 10.0 113.685 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.77 -40.18 76.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 119.658 1.117 . . . . 10.0 110.837 169.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.2 -55.17 30.54 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.709 0.686 . . . . 10.0 109.94 175.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.54 -8.83 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -96.63 -47.57 5.86 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.194 1.398 . . . . 10.0 111.567 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -117.58 -8.33 10.96 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.067 1.506 . . . . 10.0 115.067 -168.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -115.98 -44.56 2.91 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.582 1.553 . . . . 10.0 110.93 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.24 -8.07 5.18 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.81 1.041 . . . . 10.0 113.81 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.57 -15.51 58.27 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.477 1.511 . . . . 10.0 113.057 166.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -143.92 -44.87 0.27 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.934 1.694 . . . . 10.0 113.037 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -85.72 -164.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.768 2.027 . . . . 10.0 110.593 171.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.428 HG23 ' H ' ' A' ' 20' ' ' VAL . 1.4 t -150.19 -77.06 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.528 1.131 . . . . 10.0 111.153 168.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.428 ' H ' HG23 ' A' ' 19' ' ' THR 0.268 0.9 OUTLIER 49.75 -18.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 129.699 3.2 . . . . 10.0 117.204 -171.812 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 23' ' ' GLY . 14.8 pt-20 -68.42 51.21 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 129.336 3.054 . . . . 10.0 113.315 175.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 mttm 57.71 -21.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 129.466 3.106 . . . . 10.0 117.013 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.422 ' H ' ' C ' ' A' ' 21' ' ' GLU . . . -75.69 75.64 1.43 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 126.501 2.0 . . . . 10.0 112.637 175.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -53.69 101.19 0.08 OUTLIER Glycine 0 CA--C 1.534 1.223 0 C-N-CA 126.135 1.826 . . . . 10.0 114.745 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -164.81 65.99 0.14 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.389 1.876 . . . . 10.0 112.082 -167.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.454 ' CD2' ' H ' ' A' ' 26' ' ' HIS . 1.7 p80 -64.39 115.48 5.14 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 167.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -142.14 -25.59 0.66 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.968 0.907 . . . . 10.0 113.348 -164.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 m -153.01 -19.59 0.15 Allowed 'General case' 0 N--CA 1.477 0.897 0 O-C-N 120.794 -1.191 . . . . 10.0 111.884 167.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.06 150.85 17.27 Favored Glycine 0 CA--C 1.546 2.02 0 C-N-CA 124.666 1.127 . . . . 10.0 111.689 161.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -78.4 38.98 0.73 Allowed 'Trans proline' 0 CA--C 1.542 0.911 1 C-N-CA 125.354 4.036 . . . . 10.0 116.634 -163.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 56.42 -163.37 0.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.646 -1.284 . . . . 10.0 110.22 -161.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.56 27.44 1.53 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.28 1.832 . . . . 10.0 111.577 172.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.14 107.26 0.22 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.635 2.374 . . . . 10.0 114.339 -176.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.03 11.34 58.35 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 126.084 1.802 . . . . 10.0 115.045 173.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 161.89 4.21 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.174 0.987 . . . . 10.0 110.403 166.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 62.77 44.43 6.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.564 1.546 . . . . 10.0 113.121 -155.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 164.08 -44.13 0.31 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.452 1.501 . . . . 10.0 111.034 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 -82.24 159.09 23.29 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.411 0.624 . . . . 10.0 111.495 169.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -85.36 164.92 17.66 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.96 1.304 . . . . 10.0 111.66 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.9 t -60.65 151.35 29.35 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.882 1.273 . . . . 10.0 111.787 171.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.36 8.44 49.85 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 117.154 1.622 . . . . 10.0 117.154 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.527 ' H ' ' NE2' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -65.87 -15.73 63.19 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 115.604 1.705 . . . . 10.0 115.604 -171.258 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.38 109.43 1.37 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.452 1.901 . . . . 10.0 114.868 -162.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.04 52.92 3.99 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.469 3.446 . . . . 10.0 112.395 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 126.94 73.84 0.19 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.498 1.523 . . . . 10.0 112.328 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -157.2 -79.94 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.918 0.887 . . . . 10.0 111.485 171.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 24.7 m 55.28 102.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.511 1.525 . . . . 10.0 112.176 -155.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -55.03 4.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.582 1.953 . . . . 10.0 110.305 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 71.9 p -144.69 175.81 9.89 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.216 2.606 . . . . 10.0 108.04 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -76.6 -60.48 2.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.804 1.642 . . . . 10.0 112.84 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.16 -52.45 65.29 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.766 1.226 . . . . 10.0 113.883 -153.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -58.82 -58.87 6.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.599 0.76 . . . . 10.0 112.885 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -39.95 76.34 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.528 1.131 . . . . 10.0 113.139 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -61.67 -34.91 76.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.178 0.899 . . . . 10.0 113.241 173.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -75.13 -10.99 59.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.118 1.525 . . . . 10.0 115.118 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.06 12.29 57.23 Favored Glycine 0 CA--C 1.542 1.781 0 N-CA-C 117.663 1.825 . . . . 10.0 117.663 163.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -55.4 4.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 119.449 3.129 . . . . 10.0 119.449 -161.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 m 55.62 104.58 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.825 2.45 . . . . 10.0 114.625 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.513 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 9.1 m95 -72.53 119.49 16.82 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 121.182 -0.949 . . . . 10.0 111.777 171.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.49 ' HZ2' ' CD ' ' A' ' 62' ' ' GLU . 21.3 tttm -163.81 167.84 20.34 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.593 1.157 . . . . 10.0 111.146 -155.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -68.61 23.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.81 2.844 . . . . 10.0 114.427 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.49 ' CD ' ' HZ2' ' A' ' 60' ' ' LYS . 3.5 mp0 -158.91 17.48 0.19 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.895 2.878 . . . . 10.0 110.651 -168.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.7 p -158.45 -37.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.244 1.818 . . . . 10.0 110.656 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.38 -22.27 57.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 114.424 1.268 . . . . 10.0 114.424 174.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.7 mtm -67.76 -52.73 33.93 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.88 0.763 . . . . 10.0 110.686 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -61.97 -41.47 98.04 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.46 0.475 . . . . 10.0 110.527 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.76 -53.23 43.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 113.316 0.858 . . . . 10.0 113.316 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.7 tp -65.96 -33.47 75.9 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.062 1.301 . . . . 10.0 112.415 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -70.34 -28.3 65.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 172.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -161.38 75.94 2.42 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.626 1.17 . . . . 10.0 112.353 -172.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.99 -48.68 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.612 2.208 . . . . 10.0 111.93 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 32.38 0.08 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.35 2.26 . . . . 10.0 114.268 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.26 -43.65 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 128.006 2.522 . . . . 10.0 110.45 -167.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -68.06 -36.82 80.5 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 174.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.44 143.55 41.57 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.702 0.801 . . . . 10.0 111.224 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -76.72 158.75 35.4 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.151 2.568 . . . . 10.0 111.379 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 57.49 55.8 28.5 Favored Glycine 0 C--N 1.34 0.778 0 C-N-CA 123.868 0.747 . . . . 10.0 112.044 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -126.68 151.01 48.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.125 1.77 . . . . 10.0 109.445 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -142.55 5.92 1.63 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.332 1.453 . . . . 10.0 113.87 -169.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -54.75 92.64 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.746 1.618 . . . . 10.0 113.035 173.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.77 83.22 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.484 1.514 . . . . 10.0 110.069 175.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -162.3 -53.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.069 0.766 . . . . 10.0 113.069 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.71 87.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.078 2.551 . . . . 10.0 117.254 168.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.78 95.87 1.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 123.374 0.511 . . . . 10.0 112.134 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.65 -21.11 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -166.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 88' ' ' LYS . 0.6 OUTLIER 73.63 148.33 0.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.162 2.585 . . . . 10.0 110.943 -174.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm 46.95 -13.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 130.554 3.541 . . . . 10.0 118.298 -162.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 86' ' ' LYS . 43.6 mttm 49.11 -9.72 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 131.406 3.882 . . . . 10.0 118.754 163.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.0 m -63.9 -26.77 68.75 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 122.726 2.512 . . . . 10.0 111.188 156.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -53.29 -33.32 52.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.195 0.998 . . . . 10.0 112.955 163.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -66.59 -44.49 82.02 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 116.981 -1.485 . . . . 10.0 110.404 172.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.17 -45.42 93.15 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.419 1.009 . . . . 10.0 110.335 177.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -59.79 -49.42 77.8 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.467 1.507 . . . . 10.0 110.911 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -40.95 97.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.469 0.914 . . . . 10.0 113.469 174.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.8 mm -54.71 -56.2 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 171.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.54 42.76 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.028 0.931 . . . . 10.0 111.075 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.436 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 9.2 t80 -52.0 -59.11 4.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.081 1.752 . . . . 10.0 112.36 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.436 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 15.1 mt -71.51 -30.91 66.48 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.946 0.794 . . . . 10.0 113.01 -175.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -52.97 62.37 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 118.995 0.816 . . . . 10.0 109.862 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -37.72 82.51 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 117.453 -1.26 . . . . 10.0 113.189 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.73 -7.18 4.45 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.8 p -69.41 -16.92 63.6 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.883 -1.136 . . . . 10.0 113.538 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -153.61 43.73 0.59 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.77 1.228 . . . . 10.0 111.8 -162.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 129.635 3.174 . . . . 10.0 110.506 163.276 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.513 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.019 0 N-CA-C 109.693 -1.363 . . . . 10.0 109.693 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -109.33 150.56 27.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.147 0.979 . . . . 10.0 111.562 -174.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.6 m -70.8 -40.27 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 121.244 -0.91 . . . . 10.0 112.24 -174.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 mp0 -59.12 -51.84 68.3 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.425 1.49 . . . . 10.0 110.288 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -56.93 -21.61 31.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.995 1.718 . . . . 10.0 114.167 174.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.74 -43.04 3.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 119.074 0.852 . . . . 10.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -60.8 -42.04 96.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.797 1.298 . . . . 10.0 112.757 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -36.51 81.8 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.55 1.14 . . . . 10.0 112.627 -176.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -85.99 -34.53 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 124.059 0.944 . . . . 10.0 111.217 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -57.35 -50.88 71.54 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 118.929 0.786 . . . . 10.0 110.318 171.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.4 t -65.01 -8.1 5.05 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -97.67 -48.69 5.13 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.241 1.417 . . . . 10.0 112.56 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.75 -0.24 9.68 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.391 1.626 . . . . 10.0 115.391 -171.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.2 m -117.61 -43.47 2.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.862 1.265 . . . . 10.0 111.655 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.88 -10.09 8.47 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -16.62 52.6 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 10.0 112.854 167.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.1 m -143.24 -34.82 0.41 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.468 1.507 . . . . 10.0 114.002 -175.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -105.45 174.25 5.96 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.362 2.665 . . . . 10.0 111.837 -178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.0 m -160.92 90.29 0.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 119.735 -1.853 . . . . 10.0 112.732 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.8 p -95.76 -36.26 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 N-CA-C 114.103 1.149 . . . . 10.0 114.103 171.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.406 ' O ' ' HE3' ' A' ' 22' ' ' LYS . 3.8 tt0 -71.96 -0.73 12.22 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.838 -1.164 . . . . 10.0 114.061 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 21' ' ' GLU . 11.8 mmtp -151.54 -166.27 2.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.057 2.543 . . . . 10.0 107.115 -169.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -66.24 53.81 0.18 Allowed Glycine 0 CA--C 1.541 1.692 0 N-CA-C 118.058 1.983 . . . . 10.0 118.058 -167.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.85 8.01 56.63 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 117.54 1.776 . . . . 10.0 117.54 156.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -64.57 159.48 21.69 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.348 1.059 . . . . 10.0 112.42 -173.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -152.41 91.29 1.57 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.753 1.621 . . . . 10.0 108.259 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -96.58 -29.21 13.98 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.703 1.601 . . . . 10.0 113.194 -167.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 91.1 m -154.1 -20.04 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 O-C-N 120.963 -1.086 . . . . 10.0 111.903 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -116.97 171.67 13.9 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 110.499 -1.04 . . . . 10.0 110.499 154.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -61.65 178.98 0.56 Allowed 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.846 5.031 . . . . 10.0 114.167 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -83.53 -10.24 58.43 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.325 1.602 . . . . 10.0 115.325 -168.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.4 mp 45.5 69.42 0.45 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.618 1.167 . . . . 10.0 110.59 -158.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.402 ' CE1' HH21 ' A' ' 38' ' ' ARG . 0.5 OUTLIER -55.56 -179.24 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.64 1.176 . . . . 10.0 111.51 163.19 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -36.53 137.92 0.45 Allowed Glycine 0 CA--C 1.538 1.523 0 O-C-N 121.491 -0.756 . . . . 10.0 112.356 161.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -151.86 171.74 17.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 130.064 3.346 . . . . 10.0 109.097 -167.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 68.38 86.19 0.13 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.03 1.732 . . . . 10.0 112.784 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.4 60.71 1.43 Allowed Glycine 0 CA--C 1.527 0.809 0 CA-C-N 115.016 -0.993 . . . . 10.0 112.989 172.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.402 HH21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -152.21 -94.26 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.494 1.118 . . . . 10.0 110.328 172.815 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -154.5 -129.41 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.651 1.18 . . . . 10.0 110.608 165.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.9 t -158.63 167.69 28.89 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 128.33 2.652 . . . . 10.0 108.082 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.18 46.29 4.17 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 115.98 1.152 . . . . 10.0 115.98 174.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -128.94 1.0 5.32 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.651 1.723 . . . . 10.0 115.651 -173.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.85 116.91 27.39 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 120.855 1.661 . . . . 10.0 112.225 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.83 -39.25 0.69 Allowed 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.495 2.13 . . . . 10.0 114.197 -158.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -119.15 49.08 0.89 Allowed Glycine 0 C--N 1.34 0.788 0 C-N-CA 124.439 1.018 . . . . 10.0 112.322 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -141.72 -41.04 0.36 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 118.384 -0.817 . . . . 10.0 113.172 -172.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 t 43.91 87.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.493 1.917 . . . . 10.0 115.297 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -172.9 4.03 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 126.647 1.979 . . . . 10.0 113.283 -172.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.7 p -64.13 155.45 31.49 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.222 -0.924 . . . . 10.0 111.793 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.18 -50.39 16.39 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.847 2.059 . . . . 10.0 112.41 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.32 30.64 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 128.379 2.672 . . . . 10.0 116.464 -164.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -161.23 -70.16 0.06 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.039 3.336 . . . . 10.0 107.145 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.512 ' HZ1' ' CGD' ' A' ' 105' ' ' HEC . 0.1 OUTLIER -64.22 -55.3 22.59 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.997 1.719 . . . . 10.0 112.555 178.133 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.9 -32.34 73.8 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.269 0.94 . . . . 10.0 112.021 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -60.66 -16.56 40.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.011 1.325 . . . . 10.0 113.337 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.68 14.93 79.51 Favored Glycine 0 CA--C 1.535 1.308 0 N-CA-C 115.914 1.126 . . . . 10.0 115.914 163.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -55.45 0.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.219 2.607 . . . . 10.0 117.993 -167.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.8 m 55.47 107.51 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 128.941 2.896 . . . . 10.0 115.161 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.407 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 8.1 m95 -67.82 131.63 45.88 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.747 0.784 . . . . 10.0 112.576 170.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -165.1 162.66 20.35 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.348 1.459 . . . . 10.0 110.682 -155.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.35 35.28 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 129.399 3.08 . . . . 10.0 113.602 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -162.06 -74.54 0.05 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 128.235 2.614 . . . . 10.0 107.578 -164.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.4 p -57.88 -37.03 73.24 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.064 2.145 . . . . 10.0 112.582 -176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -23.61 55.49 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.765 1.226 . . . . 10.0 113.68 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 35.7 mtm -71.99 -48.27 46.05 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.65 -0.656 . . . . 10.0 109.948 170.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -57.5 -51.79 68.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.657 1.183 . . . . 10.0 110.829 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -59.3 -52.03 67.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 118.308 -0.853 . . . . 10.0 112.44 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -48.04 79.59 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.591 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.6 -29.13 70.37 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.27 1.211 . . . . 10.0 114.27 -177.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -162.25 97.71 1.17 Allowed Pre-proline 0 CA--C 1.546 0.8 0 CA-C-N 119.156 0.889 . . . . 10.0 112.01 161.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.14 -49.22 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.398 2.065 . . . . 10.0 110.838 -172.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -61.4 -23.19 65.63 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.956 1.702 . . . . 10.0 113.775 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -52.56 9.54 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.028 1.331 . . . . 10.0 112.273 163.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -61.85 -32.38 72.71 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.122 0.786 . . . . 10.0 113.122 -175.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.54 148.0 54.42 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 126.077 1.751 . . . . 10.0 110.82 172.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.42 -8.45 19.59 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.94 2.427 . . . . 10.0 114.094 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -141.25 78.52 0.29 Allowed Glycine 0 C--N 1.34 0.763 0 C-N-CA 123.938 0.78 . . . . 10.0 113.126 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.7 m -133.91 119.46 19.14 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.746 0.818 . . . . 10.0 113.091 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -85.99 6.12 30.18 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 116.016 1.858 . . . . 10.0 116.016 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.57 109.32 0.68 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.438 1.095 . . . . 10.0 111.364 173.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 26.0 mm -83.74 77.31 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 124.999 1.319 . . . . 10.0 110.035 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -163.85 -42.74 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 167.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.67 -146.19 0.2 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.296 1.038 . . . . 10.0 113.198 -162.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.0 150.26 28.86 Favored Glycine 0 C--N 1.343 0.949 0 C-N-CA 124.607 1.099 . . . . 10.0 115.479 -163.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 tt -69.58 -9.86 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.552 1.316 . . . . 10.0 114.552 -163.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.2 tttm 56.68 51.11 11.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.686 1.994 . . . . 10.0 111.716 -178.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.31 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.046 1.738 . . . . 10.0 115.235 175.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 mptt 47.5 -56.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 129.441 3.096 . . . . 10.0 116.351 -162.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.5 m -58.66 -37.61 76.36 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 121.358 1.89 . . . . 10.0 112.495 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -52.75 -38.47 60.96 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.356 0.662 . . . . 10.0 111.86 171.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -46.69 89.48 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.839 -1.163 . . . . 10.0 110.932 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.95 -22.77 55.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.783 1.031 . . . . 10.0 113.783 175.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -62.85 -49.76 73.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.813 1.188 . . . . 10.0 110.264 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mp -59.51 -40.58 87.58 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.148 -0.97 . . . . 10.0 113.29 174.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.59 -48.79 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 119.053 0.842 . . . . 10.0 109.022 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -50.23 74.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.101 0.409 . . . . 10.0 111.344 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -53.71 -55.73 23.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.006 1.323 . . . . 10.0 112.847 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.97 -28.71 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.326 0.966 . . . . 10.0 112.608 -175.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -66.63 -18.96 65.65 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.376 1.071 . . . . 10.0 112.625 171.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -85.95 -58.19 2.74 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 117.223 -1.37 . . . . 10.0 111.377 158.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.16 -18.62 37.85 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 115.948 1.833 . . . . 10.0 115.948 -170.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.2 t -64.19 -19.97 65.7 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.011 1.324 . . . . 10.0 114.509 166.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.22 -4.21 0.2 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.538 2.051 . . . . 10.0 116.538 -167.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 C--O 1.25 1.095 0 C-N-CA 126.155 1.782 . . . . 10.0 111.274 -171.525 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.512 ' CGD' ' HZ1' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 CA-C-O 118.111 -1.383 . . . . 10.0 114.828 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -80.7 163.98 23.15 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.606 1.703 . . . . 10.0 111.442 166.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.03 -50.3 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.678 1.191 . . . . 10.0 110.597 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.36 -49.95 65.16 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.951 -1.093 . . . . 10.0 113.114 -170.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -57.29 -32.1 66.3 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.732 0.413 . . . . 10.0 111.527 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.34 -41.74 58.32 Favored Glycine 0 C--N 1.34 0.754 0 C-N-CA 124.535 1.064 . . . . 10.0 111.287 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -69.7 -33.8 73.02 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 118.15 0.975 . . . . 10.0 111.978 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -53.58 55.9 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.932 1.293 . . . . 10.0 110.311 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.96 -33.19 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 118.61 -0.709 . . . . 10.0 112.696 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.419 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.7 t80 -56.59 -54.08 50.18 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 119.725 1.148 . . . . 10.0 110.723 170.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.87 -10.09 6.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 112.932 0.715 . . . . 10.0 112.932 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -90.06 -52.32 5.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.195 1.398 . . . . 10.0 111.354 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -134.55 10.12 3.7 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -167.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.0 m -113.26 -42.29 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.11 1.364 . . . . 10.0 110.719 167.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.35 -14.61 19.54 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -66.13 -10.28 39.41 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.923 1.689 . . . . 10.0 114.741 168.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -143.43 -34.68 0.4 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.76 1.224 . . . . 10.0 112.98 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -114.41 -175.42 2.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.597 2.359 . . . . 10.0 111.956 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -146.04 176.74 9.49 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.317 0.647 . . . . 10.0 110.756 151.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.3 p -162.34 -41.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 127.139 2.176 . . . . 10.0 109.765 156.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -67.47 -51.9 45.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.996 0.918 . . . . 10.0 111.091 166.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -85.26 82.87 8.19 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.5 1.12 . . . . 10.0 110.158 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.7 -73.69 0.16 Allowed Glycine 0 CA--C 1.534 1.23 0 C-N-CA 127.341 2.401 . . . . 10.0 115.757 167.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 154.6 114.93 0.53 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.122 1.344 . . . . 10.0 111.984 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -163.86 157.26 18.59 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.707 2.003 . . . . 10.0 110.747 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -156.19 108.16 2.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.744 2.018 . . . . 10.0 107.369 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -144.27 -82.08 0.17 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.286 1.034 . . . . 10.0 110.866 -167.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -23.76 42.15 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 117.984 0.356 . . . . 10.0 110.957 177.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -144.51 175.92 23.97 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.814 2.15 . . . . 10.0 110.82 160.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.07 -179.18 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.273 3.982 . . . . 10.0 113.936 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -93.68 16.27 14.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.347 2.659 . . . . 10.0 115.741 -169.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp 38.85 55.1 2.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.99 2.116 . . . . 10.0 112.924 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -56.94 84.73 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.595 2.758 . . . . 10.0 114.112 -178.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.25 32.19 60.07 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.413 1.482 . . . . 10.0 114.962 166.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.0 179.25 0.71 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.183 0.993 . . . . 10.0 113.429 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.447 ' CB ' ' HE2' ' A' ' 99' ' ' LYS . 4.1 m-85 52.81 42.95 31.98 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 124.802 1.241 . . . . 10.0 111.068 -166.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 1.68 0.07 OUTLIER Glycine 0 CA--C 1.542 1.77 0 C-N-CA 126.945 2.212 . . . . 10.0 115.208 -163.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.9 mtp85 -152.41 163.33 39.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.118 1.767 . . . . 10.0 110.848 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -83.72 172.76 11.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.02 2.128 . . . . 10.0 112.999 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 50.6 p -81.73 179.63 7.75 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.581 1.152 . . . . 10.0 112.125 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.72 -32.1 4.07 Favored Glycine 0 CA--C 1.529 0.956 0 O-C-N 120.88 -1.137 . . . . 10.0 114.5 176.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 44.3 mm-40 -64.98 6.32 0.25 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 128.708 2.803 . . . . 10.0 116.623 -161.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.17 145.0 79.76 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 119.405 1.002 . . . . 10.0 108.939 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.57 70.31 4.97 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.415 2.743 . . . . 10.0 111.323 -177.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.444 ' C ' ' H ' ' A' ' 47' ' ' THR . . . 68.35 -79.27 0.23 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.918 1.723 . . . . 10.0 111.987 -173.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 48.62 -14.33 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 130.438 3.495 . . . . 10.0 117.883 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 45' ' ' GLY . 26.2 m 76.38 75.82 0.09 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 129.787 3.235 . . . . 10.0 112.025 -171.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -84.27 170.0 14.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.943 1.297 . . . . 10.0 111.849 159.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 82.1 p -69.59 -1.37 8.64 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 116.226 1.936 . . . . 10.0 116.226 -172.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.4 t70 46.3 -157.33 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.456 0.702 . . . . 10.0 110.912 -146.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.25 -76.12 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.357 2.663 . . . . 10.0 113.147 -168.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -49.94 -71.64 0.06 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.212 1.805 . . . . 10.0 111.4 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.539 ' HZ3' ' CGA' ' A' ' 105' ' ' HEC . 29.8 mmmt -57.07 -42.3 80.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.616 1.966 . . . . 10.0 111.246 -172.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.11 -59.9 3.61 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.591 2.356 . . . . 10.0 112.525 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -62.29 -52.01 65.41 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.905 0.882 . . . . 10.0 111.552 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.3 -179.99 19.01 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 122.436 1.02 . . . . 10.0 115.203 -172.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.07 -1.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 128.747 2.819 . . . . 10.0 112.544 -169.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.8 m 55.39 106.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.86 2.064 . . . . 10.0 113.181 -162.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -67.38 123.15 19.57 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.31 -0.869 . . . . 10.0 111.692 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -162.57 178.15 8.81 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.172 2.189 . . . . 10.0 110.907 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.91 41.93 0.05 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.127 2.971 . . . . 10.0 113.344 -174.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -161.64 -64.45 0.05 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.563 3.145 . . . . 10.0 108.396 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.1 p -62.48 -43.81 97.92 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.176 1.39 . . . . 10.0 112.416 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.69 -25.3 60.17 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.131 0.573 . . . . 10.0 111.405 173.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 34.3 ttm -63.95 -52.42 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.204 0.911 . . . . 10.0 109.234 170.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -60.86 -44.67 96.7 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.499 0.72 . . . . 10.0 111.146 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.29 -48.27 76.31 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.499 -0.762 . . . . 10.0 111.674 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -42.16 99.01 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.079 1.308 . . . . 10.0 111.066 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.97 -45.51 74.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.107 0.867 . . . . 10.0 112.282 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -160.6 76.77 2.62 Favored Pre-proline 0 CA--C 1.559 1.307 0 C-N-CA 124.656 1.182 . . . . 10.0 111.034 -163.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.92 -67.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.473 3.449 . . . . 10.0 114.271 -161.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -58.64 -20.29 46.56 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.176 1.79 . . . . 10.0 113.233 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -48.06 24.58 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.828 2.051 . . . . 10.0 111.428 170.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -61.19 -41.1 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.629 0.772 . . . . 10.0 112.855 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 pt -139.53 135.89 17.29 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.711 0.805 . . . . 10.0 111.208 -175.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -78.37 65.92 8.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.438 3.425 . . . . 10.0 112.786 -168.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.36 -145.96 4.65 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 126.423 1.963 . . . . 10.0 109.614 175.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 93.0 m 74.86 147.6 0.09 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.065 2.146 . . . . 10.0 114.636 168.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -141.56 21.6 2.18 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.946 2.098 . . . . 10.0 111.666 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 21.7 ttt -59.49 98.6 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.156 1.382 . . . . 10.0 109.561 158.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.5 mp -75.57 57.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.262 1.025 . . . . 10.0 110.3 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -163.64 107.05 0.99 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.29 1.036 . . . . 10.0 111.417 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.89 -162.04 0.2 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.096 1.358 . . . . 10.0 111.942 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.26 60.26 0.01 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 127.58 2.514 . . . . 10.0 117.051 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.331 5.6 tt 44.71 -122.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.343 2.657 . . . . 10.0 112.042 175.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -142.31 -73.8 0.3 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.31 1.444 . . . . 10.0 110.15 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.81 115.52 3.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 161.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -64.04 -21.71 66.62 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.133 0.879 . . . . 10.0 111.373 170.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.7 m -53.1 -50.91 63.46 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.145 0.978 . . . . 10.0 112.339 164.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.25 -30.36 66.49 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.551 1.069 . . . . 10.0 111.341 176.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -19.57 59.48 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.545 1.138 . . . . 10.0 113.869 173.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.76 -62.97 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.398 1.454 . . . . 10.0 108.189 160.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.58 -48.48 72.05 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 126.458 1.903 . . . . 10.0 111.198 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.2 tp -60.44 -47.7 84.96 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.7 mm -65.57 -44.02 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.905 -0.497 . . . . 10.0 110.075 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.53 -35.39 80.33 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.217 1.007 . . . . 10.0 111.609 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.431 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.0 t80 -57.12 -66.44 0.45 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.675 1.19 . . . . 10.0 110.952 165.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.431 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 51.7 mt -62.86 -29.9 71.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.447 ' HE2' ' CB ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -57.46 -46.92 83.11 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.54 1.064 . . . . 10.0 110.983 172.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -91.22 -38.24 12.82 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 117.983 -1.008 . . . . 10.0 111.684 -172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.71 -13.33 9.53 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.837 1.655 . . . . 10.0 115.013 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.58 -2.38 14.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.581 1.152 . . . . 10.0 113.346 168.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -151.4 -53.8 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.73 2.012 . . . . 10.0 111.816 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 126.697 1.999 . . . . 10.0 113.215 -178.176 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.539 ' CGA' ' HZ3' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.768 0 CA-C-O 118.716 -1.047 . . . . 10.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -136.82 155.2 50.11 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.475 0.917 . . . . 10.0 113.475 -144.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 94.6 t -58.57 -56.09 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 126.183 1.793 . . . . 10.0 111.544 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -59.46 -36.46 75.99 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.37 1.468 . . . . 10.0 112.004 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -77.75 -8.97 58.73 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.221 1.808 . . . . 10.0 114.666 174.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.23 -41.47 5.51 Favored Glycine 0 N--CA 1.471 1.0 0 CA-C-N 119.707 1.14 . . . . 10.0 112.092 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.08 68.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.726 -0.867 . . . . 10.0 113.036 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -30.07 67.71 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.492 1.293 . . . . 10.0 114.492 177.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -86.11 -31.1 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 119.026 0.83 . . . . 10.0 110.325 173.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.457 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t80 -58.08 -52.02 67.26 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 122.072 -0.393 . . . . 10.0 111.336 169.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.86 -9.89 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.366 0.876 . . . . 10.0 113.366 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -82.55 -52.18 7.08 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.055 0.942 . . . . 10.0 110.742 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -116.06 -52.67 2.59 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.285 1.034 . . . . 10.0 112.595 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.457 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 9.5 m -59.53 -43.01 93.59 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.902 0.881 . . . . 10.0 112.666 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.2 23.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.658 1.355 . . . . 10.0 114.658 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.88 -14.77 63.11 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.618 1.099 . . . . 10.0 112.252 170.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 91.7 m -143.03 -26.95 0.58 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.665 1.358 . . . . 10.0 114.665 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.408 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.4 m-70 -109.54 -56.26 2.33 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.201 1.4 . . . . 10.0 114.127 -174.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.294 9.8 t 44.67 53.31 7.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.187 1.795 . . . . 10.0 114.016 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.71 -28.38 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 120.789 -1.194 . . . . 10.0 112.752 175.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.82 4.74 0.26 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.542 1.937 . . . . 10.0 114.712 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -149.79 13.57 0.81 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.75 2.42 . . . . 10.0 111.501 169.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.2 40.23 51.93 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.86 1.219 . . . . 10.0 112.957 -173.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.49 179.28 53.17 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 123.079 1.377 . . . . 10.0 114.52 -165.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -56.73 111.81 1.12 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.265 1.426 . . . . 10.0 113.057 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -68.02 61.01 0.08 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.61 1.964 . . . . 10.0 111.846 170.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -82.64 -19.99 37.17 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.269 1.827 . . . . 10.0 112.821 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.3 m -153.74 -18.93 0.14 Allowed 'General case' 0 N--CA 1.479 0.997 0 O-C-N 120.983 -1.073 . . . . 10.0 113.332 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.99 165.82 21.65 Favored Glycine 0 CA--C 1.54 1.656 0 CA-C-N 119.645 1.111 . . . . 10.0 110.99 157.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.408 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 49.3 Cg_endo -67.96 22.86 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.045 1 C-N-CA 126.478 4.785 . . . . 10.0 116.342 -173.728 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.349 0.0 OUTLIER 49.56 6.38 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 128.726 2.811 . . . . 10.0 117.931 -169.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.11 -34.21 0.28 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.728 2.411 . . . . 10.0 113.966 171.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.43 68.11 0.17 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 131.148 3.779 . . . . 10.0 114.13 169.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 32.85 68.05 0.18 Allowed Glycine 0 C--N 1.345 1.061 0 C-N-CA 127.587 2.517 . . . . 10.0 113.456 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -93.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.661 0.785 . . . . 10.0 112.322 -164.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 33.86 62.05 0.46 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.749 2.42 . . . . 10.0 115.358 161.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.35 -24.32 16.11 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.095 1.807 . . . . 10.0 114.151 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -68.06 168.18 12.5 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.955 1.378 . . . . 10.0 111.059 164.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -84.96 166.04 17.09 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.082 1.141 . . . . 10.0 114.082 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.4 p -67.55 -71.57 0.2 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 128.42 2.688 . . . . 10.0 112.964 -174.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -73.5 67.7 1.55 Allowed Glycine 0 C--N 1.339 0.703 0 C-N-CA 126.99 2.233 . . . . 10.0 112.988 -171.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.86 -2.98 7.73 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -173.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.06 118.84 59.47 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.551 1.14 . . . . 10.0 111.592 -176.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.89 81.75 1.86 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.069 2.513 . . . . 10.0 113.088 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.96 -7.75 70.09 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 125.403 1.478 . . . . 10.0 115.249 170.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -64.37 113.72 3.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.047 1.339 . . . . 10.0 110.615 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 m -71.18 142.55 50.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.399 1.48 . . . . 10.0 111.657 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.616 ' CG ' ' HE3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -155.0 178.41 10.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.082 1.142 . . . . 10.0 114.082 -169.221 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 p -67.52 120.93 14.77 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 10.0 111.924 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -75.07 36.38 0.11 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.676 1.59 . . . . 10.0 113.601 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.97 11.45 2.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.128 1.371 . . . . 10.0 114.625 -166.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.66 -33.97 0.05 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 117.905 -1.045 . . . . 10.0 113.791 -168.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.616 ' HE3' ' CG ' ' A' ' 48' ' ' TYR . 1.7 mppt? -64.48 -48.81 73.83 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.763 1.165 . . . . 10.0 108.071 166.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -49.01 -34.89 14.07 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.133 3.773 . . . . 10.0 113.82 176.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -68.71 -16.36 63.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.832 1.049 . . . . 10.0 113.832 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 58' ' ' THR . . . 70.94 5.13 57.3 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.296 1.279 . . . . 10.0 116.296 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.9 pp -61.24 14.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 128.995 2.918 . . . . 10.0 116.706 -173.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.401 ' H ' ' C ' ' A' ' 56' ' ' GLY . 99.9 m 40.6 81.14 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.568 2.747 . . . . 10.0 112.504 155.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -54.6 137.08 44.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.167 1.387 . . . . 10.0 111.692 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.258 0.0 OUTLIER -161.46 -73.72 0.06 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.734 1.383 . . . . 10.0 114.734 -164.006 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -164.68 20.32 0.06 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 121.145 1.793 . . . . 10.0 113.092 -171.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -160.72 -63.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.963 1.305 . . . . 10.0 107.898 -162.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 46.3 p -60.81 -46.82 89.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 126.979 2.112 . . . . 10.0 110.651 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -28.86 66.47 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.932 1.293 . . . . 10.0 112.324 174.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.7 ttm -65.13 -51.13 63.1 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.053 0.541 . . . . 10.0 109.854 173.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -61.56 -46.18 90.99 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.269 1.028 . . . . 10.0 110.352 176.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.29 -53.01 50.31 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 118.585 -0.721 . . . . 10.0 112.799 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -26.44 66.71 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.257 1.389 . . . . 10.0 111.798 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.53 -25.2 45.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.976 1.473 . . . . 10.0 114.976 169.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.46 72.25 1.87 Allowed Pre-proline 0 CA--C 1.563 1.451 0 CA-C-N 119.746 1.157 . . . . 10.0 113.442 -174.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -71.5 -57.54 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.454 2.103 . . . . 10.0 113.283 -161.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.8 mttm -62.6 -27.88 69.5 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 127.081 2.153 . . . . 10.0 112.456 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.28 -46.62 32.38 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 126.284 1.834 . . . . 10.0 110.764 172.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -61.03 -49.29 78.01 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.271 0.841 . . . . 10.0 113.271 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 pt -135.97 131.29 18.86 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.661 0.784 . . . . 10.0 111.155 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -80.75 64.71 8.92 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.228 3.285 . . . . 10.0 113.33 -159.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 149.85 88.67 0.07 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 123.769 0.699 . . . . 10.0 111.59 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 19.0 m -143.89 100.26 3.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.616 1.166 . . . . 10.0 109.407 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -81.35 7.99 10.26 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.383 1.873 . . . . 10.0 115.0 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.3 ttt -50.14 107.55 0.17 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.106 0.866 . . . . 10.0 110.379 156.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.419 HD13 ' H ' ' A' ' 81' ' ' ILE . 3.0 mp -78.49 59.2 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.936 1.295 . . . . 10.0 110.521 -175.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -162.93 92.44 0.77 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.307 1.043 . . . . 10.0 110.358 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.36 -14.62 60.48 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.453 1.649 . . . . 10.0 115.453 -172.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -179.95 159.09 23.22 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.753 1.168 . . . . 10.0 111.19 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.434 HG21 ' H ' ' A' ' 86' ' ' LYS 0.315 20.5 tt -96.06 -96.29 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 -168.255 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 86' ' ' LYS . 9.3 mmpt? -146.83 103.4 3.63 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.017 1.327 . . . . 10.0 110.995 -171.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 47.22 -73.7 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 129.352 3.061 . . . . 10.0 114.421 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -164.18 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.825 1.65 . . . . 10.0 112.931 157.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 m -52.71 -52.29 56.74 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.771 1.228 . . . . 10.0 112.592 -171.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -58.89 -26.37 64.22 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.984 0.811 . . . . 10.0 112.622 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -23.66 58.18 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.559 0.743 . . . . 10.0 112.251 176.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -70.28 -53.89 14.96 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.085 -1.009 . . . . 10.0 110.101 168.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.08 -47.32 78.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 10.0 110.544 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 45.5 tp -56.93 -48.29 78.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.735 1.614 . . . . 10.0 113.821 172.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 15.4 mm -61.69 -44.36 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 118.858 0.754 . . . . 10.0 109.911 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.22 84.05 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.548 0.739 . . . . 10.0 111.82 175.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -55.62 -60.51 3.33 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.52 0.728 . . . . 10.0 111.756 171.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.77 -21.65 62.48 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.794 1.179 . . . . 10.0 113.99 -172.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.76 -59.77 4.26 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.485 0.714 . . . . 10.0 109.989 159.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 mmtt -61.89 -28.23 69.36 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.36 -1.305 . . . . 10.0 113.387 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.72 -13.92 7.24 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.801 1.637 . . . . 10.0 114.698 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.8 p -74.61 -20.58 59.86 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.882 1.438 . . . . 10.0 114.882 166.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -155.8 15.87 0.36 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 115.175 1.546 . . . . 10.0 115.175 -164.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 115.314 -2.279 . . . . 10.0 113.819 173.636 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 111.013 -0.835 . . . . 10.0 111.013 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.06 151.51 28.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.32 2.248 . . . . 10.0 114.404 -163.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -58.13 -35.62 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 120.763 -1.21 . . . . 10.0 113.228 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 -63.81 -48.89 75.06 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.564 1.546 . . . . 10.0 111.216 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -57.57 -34.11 68.85 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.589 0.755 . . . . 10.0 111.574 172.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.79 -51.61 39.54 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.15 -1.18 . . . . 10.0 110.15 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.259 1.1 ptpm? -64.16 -38.25 90.39 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 118.401 1.101 . . . . 10.0 113.657 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.26 -37.7 78.06 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.595 1.089 . . . . 10.0 113.357 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mm -69.4 -39.99 79.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 120.025 1.284 . . . . 10.0 110.96 172.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -56.38 -49.01 75.69 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.544 -0.723 . . . . 10.0 110.35 174.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.15 -11.59 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.976 1.102 . . . . 10.0 113.976 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -84.95 -33.75 22.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.329 1.051 . . . . 10.0 112.275 -177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -132.02 -63.52 0.81 Allowed 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 126.159 1.784 . . . . 10.0 111.148 -172.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 m -53.64 -47.73 70.05 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.551 1.14 . . . . 10.0 112.784 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.24 -17.57 62.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.046 1.128 . . . . 10.0 114.046 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.01 -7.82 32.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.268 1.427 . . . . 10.0 112.781 174.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -141.67 -21.28 0.74 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.613 1.565 . . . . 10.0 113.186 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -126.23 -5.74 6.62 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -170.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.2 m 54.94 -79.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.934 2.093 . . . . 10.0 116.193 -177.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.8 t 46.95 -59.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.276 1 C-N-CA 131.711 4.004 . . . . 10.0 116.041 -167.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -71.72 14.05 0.23 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.511 1.924 . . . . 10.0 113.687 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -153.78 -166.53 2.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.474 2.71 . . . . 10.0 108.522 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.99 59.97 0.15 Allowed Glycine 0 CA--C 1.541 1.716 0 C-N-CA 125.552 1.548 . . . . 10.0 116.332 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.7 -1.05 1.29 Allowed Glycine 0 CA--C 1.531 1.085 0 N-CA-C 120.709 3.044 . . . . 10.0 120.709 153.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.01 155.35 8.31 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.972 1.386 . . . . 10.0 112.736 -172.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -152.04 133.56 14.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.196 2.199 . . . . 10.0 106.999 -169.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -144.14 -86.86 0.13 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.783 0.833 . . . . 10.0 110.206 -170.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 m -81.23 -9.48 59.77 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.735 1.214 . . . . 10.0 111.886 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -138.8 173.66 22.48 Favored Glycine 0 CA--C 1.544 1.871 0 C-N-CA 126.51 2.005 . . . . 10.0 110.716 162.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 66.9 Cg_endo -71.64 -144.86 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.08 1 C-N-CA 125.379 4.052 . . . . 10.0 109.741 168.193 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -142.81 150.98 40.66 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 119.87 -1.769 . . . . 10.0 110.452 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.62 70.61 7.39 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 81.98 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 10.0 110.234 172.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.1 -67.78 0.48 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.584 2.516 . . . . 10.0 113.303 -176.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.11 -161.68 0.16 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.817 1.647 . . . . 10.0 111.064 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 60.43 64.37 1.22 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.204 1.801 . . . . 10.0 111.422 -173.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.7 42.58 0.86 Allowed Glycine 0 CA--C 1.532 1.151 0 CA-C-N 113.451 -1.704 . . . . 10.0 113.54 -172.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -150.95 150.5 30.89 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.21 1.404 . . . . 10.0 110.668 -177.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 163.59 18.41 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.909 1.077 . . . . 10.0 113.909 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.5 -16.62 58.61 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.278 1.831 . . . . 10.0 113.822 174.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.36 58.41 1.56 Allowed Glycine 0 CA--C 1.536 1.361 0 O-C-N 120.224 -1.547 . . . . 10.0 112.51 170.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -150.31 110.34 4.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.701 2.0 . . . . 10.0 112.238 -170.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.84 157.3 14.01 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.791 1.636 . . . . 10.0 110.376 165.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -84.81 -126.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 124.684 3.589 . . . . 10.0 109.215 159.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.92 79.78 0.37 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.368 1.461 . . . . 10.0 113.48 177.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 78.6 t80 -144.73 176.4 9.47 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.352 1.861 . . . . 10.0 110.714 172.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 96.7 m -154.39 100.03 2.25 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.881 -1.762 . . . . 10.0 110.832 171.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.61 167.64 16.07 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.338 2.255 . . . . 10.0 112.008 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.8 p -70.7 130.62 42.23 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.125 0.964 . . . . 10.0 111.051 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -33.2 71.86 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.364 1.616 . . . . 10.0 115.364 -162.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.25 -14.57 60.94 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.207 1.188 . . . . 10.0 114.207 -177.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -64.62 -70.06 0.25 Allowed 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.77 1.168 . . . . 10.0 110.244 169.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.16 -41.9 28.13 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.447 1.099 . . . . 10.0 112.104 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.17 -23.66 67.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.835 1.254 . . . . 10.0 114.002 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -74.01 -24.33 59.55 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.26 0.936 . . . . 10.0 112.677 170.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 65.32 12.62 56.22 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 116.844 1.498 . . . . 10.0 116.844 160.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.17 -12.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 129.221 3.008 . . . . 10.0 118.38 -160.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.0 m 56.73 118.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 128.197 2.599 . . . . 10.0 114.006 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 29.0 m95 -75.4 122.17 23.38 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.107 -0.951 . . . . 10.0 112.543 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -163.94 -177.94 5.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 130.207 3.403 . . . . 10.0 107.663 169.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.4 ' C ' ' H ' ' A' ' 63' ' ' THR . 2.7 pm0 -46.71 -57.94 4.35 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.956 1.253 . . . . 10.0 112.654 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -57.93 15.89 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 130.093 3.357 . . . . 10.0 116.691 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.4 ' H ' ' C ' ' A' ' 61' ' ' GLU . 57.8 p -158.15 -43.07 0.06 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.221 1.809 . . . . 10.0 109.976 -175.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.82 -33.54 60.08 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.735 1.214 . . . . 10.0 113.102 174.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.6 tpp -65.93 -48.96 69.66 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.803 0.729 . . . . 10.0 109.472 174.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.74 -43.87 97.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.634 1.173 . . . . 10.0 109.953 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -58.02 -64.61 0.85 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.224 -0.893 . . . . 10.0 111.719 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -24.4 67.58 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.494 1.497 . . . . 10.0 113.686 -174.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -73.48 -22.87 60.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.745 1.387 . . . . 10.0 114.745 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.98 71.13 2.35 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 120.194 1.361 . . . . 10.0 111.487 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.68 -48.03 0.82 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.225 1.95 . . . . 10.0 111.506 -164.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.7 mtmt -70.28 33.43 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 128.313 2.645 . . . . 10.0 114.097 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -161.91 -39.14 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 127.114 2.165 . . . . 10.0 112.0 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -65.39 -34.21 77.78 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.169 0.44 . . . . 10.0 111.721 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.98 153.25 78.43 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.396 1.078 . . . . 10.0 111.022 171.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.38 93.81 0.75 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.058 3.172 . . . . 10.0 112.757 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.69 49.17 6.25 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.962 0.745 . . . . 10.0 114.962 161.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.1 m -65.39 -19.7 66.06 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.579 1.326 . . . . 10.0 114.579 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 64.87 -45.93 0.34 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.417 2.287 . . . . 10.0 115.653 -176.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.2 ttt 2.7 97.51 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 129.547 3.139 . . . . 10.0 115.393 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . 0.267 9.9 tp -76.12 74.72 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 122.547 1.165 . . . . 10.0 112.237 -178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -162.45 -66.6 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.35 1.86 . . . . 10.0 109.981 170.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.11 -0.56 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 119.927 3.306 . . . . 10.0 119.927 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.17 95.5 0.22 Allowed Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.765 1.621 . . . . 10.0 113.209 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 tp -67.27 159.46 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.904 0.882 . . . . 10.0 112.19 174.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -64.71 -42.03 95.58 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.946 1.298 . . . . 10.0 114.384 -174.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.6 ptpp? -162.97 170.21 18.42 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.585 1.954 . . . . 10.0 109.555 165.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -55.91 -32.1 63.46 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.4 m -56.87 -37.27 71.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.757 1.223 . . . . 10.0 113.235 173.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -77.19 -15.53 59.46 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.698 1.199 . . . . 10.0 114.147 171.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.406 HH21 HG12 ' A' ' 95' ' ' ILE . 0.0 OUTLIER -76.54 -48.76 18.33 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.237 -1.539 . . . . 10.0 110.866 166.429 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -54.53 -55.47 28.86 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.94 1.296 . . . . 10.0 111.775 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -63.69 -35.48 80.7 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.149 0.796 . . . . 10.0 113.149 -172.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.1 mp -62.08 -42.61 99.38 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.834 1.254 . . . . 10.0 112.687 170.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.406 HG12 HH21 ' A' ' 91' ' ' ARG . 21.8 mm -59.57 -50.89 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.592 0.633 . . . . 10.0 109.754 171.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.62 83.57 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.752 0.821 . . . . 10.0 112.045 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -56.6 -57.49 12.13 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.904 1.282 . . . . 10.0 111.635 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.95 -25.88 62.92 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.927 1.239 . . . . 10.0 112.741 -173.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? -61.07 -29.17 69.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.242 1.017 . . . . 10.0 112.637 165.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -76.54 -51.65 11.29 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 125.145 1.378 . . . . 10.0 110.989 163.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.65 -22.51 13.85 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 121.474 1.943 . . . . 10.0 116.11 -174.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.8 0.73 12.24 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 169.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -153.92 -16.82 0.14 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 128.046 2.538 . . . . 10.0 115.499 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.255 1.356 0 C-N-CA 127.703 2.401 . . . . 10.0 111.792 -163.829 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.194 0 CA-C-O 118.217 -1.324 . . . . 10.0 113.642 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -134.55 118.0 16.79 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.627 . . . . 10.0 111.036 -139.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.7 p -50.27 -38.45 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.515 1.126 . . . . 10.0 112.658 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -59.78 -38.73 82.67 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.343 1.457 . . . . 10.0 113.724 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -73.98 -30.45 62.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.448 0.699 . . . . 10.0 110.766 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 8' ' ' LYS . . . -73.47 -50.71 11.13 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 -172.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 26.98 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.701 2.4 . . . . 10.0 115.146 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.401 ' H ' ' C ' ' A' ' 6' ' ' GLY . 0.0 OUTLIER -161.01 -28.5 0.06 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.385 1.474 . . . . 10.0 112.693 175.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.4 tp -70.19 -37.24 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 120.775 1.625 . . . . 10.0 110.925 161.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -55.54 -51.0 68.53 Favored 'General case' 0 C--N 1.347 0.486 0 O-C-N 121.258 -0.901 . . . . 10.0 110.395 168.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 t -66.89 -8.33 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -96.19 -48.83 5.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.227 1.411 . . . . 10.0 112.169 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -125.07 6.26 7.91 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.668 1.729 . . . . 10.0 115.668 -166.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.4 m -122.61 -44.05 2.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.51 1.924 . . . . 10.0 111.011 172.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.68 -21.59 60.77 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -55.1 -11.61 0.73 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.894 2.078 . . . . 10.0 115.334 169.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.8 m -141.84 -30.22 0.59 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.079 1.752 . . . . 10.0 111.566 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.417 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.3 m-70 -105.89 -20.43 13.44 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.656 1.354 . . . . 10.0 114.656 -176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.1 p 56.13 12.96 1.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 118.364 2.727 . . . . 10.0 118.364 173.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.0 t -66.29 165.45 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.273 1.829 . . . . 10.0 112.91 -173.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 87.95 0.15 0.44 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 130.14 3.376 . . . . 10.0 112.905 177.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -151.42 -172.1 4.12 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 128.493 2.717 . . . . 10.0 108.059 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -66.49 68.87 0.16 Allowed Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.221 1.391 . . . . 10.0 112.662 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.9 -171.84 48.31 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 126.095 1.807 . . . . 10.0 114.546 -174.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -163.13 -166.51 1.28 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.86 2.864 . . . . 10.0 109.12 -175.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -152.95 91.84 1.58 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.892 0.877 . . . . 10.0 109.483 -162.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -143.47 2.07 1.24 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.508 1.523 . . . . 10.0 113.146 -165.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m -154.66 -31.21 0.11 Allowed 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.69 -1.257 . . . . 10.0 110.578 164.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.78 163.6 12.17 Favored Glycine 0 CA--C 1.544 1.871 0 N-CA-C 110.951 -0.86 . . . . 10.0 110.951 152.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.417 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 40.1 Cg_endo -75.8 0.43 9.23 Favored 'Trans proline' 0 CA--C 1.538 0.683 1 C-N-CA 125.784 4.323 . . . . 10.0 116.571 -175.258 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 64.92 145.34 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.987 2.515 . . . . 10.0 114.056 -163.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -85.26 73.29 10.61 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.225 -0.922 . . . . 10.0 109.493 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -161.93 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.469 0.707 . . . . 10.0 112.271 162.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.21 53.44 0.08 OUTLIER Glycine 0 CA--C 1.54 1.656 0 C-N-CA 127.473 2.463 . . . . 10.0 117.894 -164.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -70.8 177.9 3.37 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.033 2.533 . . . . 10.0 111.094 171.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.288 61.9 m-85 63.02 39.35 10.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.578 1.951 . . . . 10.0 112.24 -161.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.37 45.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.302 0 N-CA-C 116.3 1.28 . . . . 10.0 116.3 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.487 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -152.82 -99.45 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.498 1.649 . . . . 10.0 112.917 174.589 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.487 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -178.35 -165.94 0.1 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 131.563 3.945 . . . . 10.0 107.779 174.346 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.3 t -76.56 -140.7 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.446 1.098 . . . . 10.0 110.228 158.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.4 -69.48 3.36 Favored Glycine 0 CA--C 1.528 0.897 0 O-C-N 120.216 -1.553 . . . . 10.0 112.946 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -64.51 133.58 52.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.617 0.767 . . . . 10.0 111.648 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.85 110.75 0.84 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.93 2.092 . . . . 10.0 108.712 163.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.28 77.59 2.03 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.241 2.627 . . . . 10.0 114.498 -162.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.75 52.46 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.234 1.397 . . . . 10.0 114.587 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -64.16 -59.73 4.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.493 1.917 . . . . 10.0 114.347 -171.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m 77.52 127.07 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.165 2.586 . . . . 10.0 112.691 -164.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.17 -179.41 8.12 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.109 2.564 . . . . 10.0 111.061 -167.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -70.17 158.87 35.0 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.469 -0.769 . . . . 10.0 111.264 168.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.76 -41.98 35.7 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.888 1.811 . . . . 10.0 115.888 -176.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.02 -24.58 47.8 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.926 1.824 . . . . 10.0 115.926 -156.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -60.62 -53.4 57.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.849 0.86 . . . . 10.0 111.614 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.27 20.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.229 1.412 . . . . 10.0 111.926 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -58.1 -29.27 65.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.317 1.447 . . . . 10.0 113.727 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -72.91 -20.82 61.01 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.483 1.038 . . . . 10.0 113.759 178.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 59.06 11.08 10.51 Favored Glycine 0 CA--C 1.545 1.937 0 N-CA-C 119.217 2.447 . . . . 10.0 119.217 148.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.9 pt -50.33 -101.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 129.402 3.081 . . . . 10.0 115.796 -170.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -155.1 -27.42 0.11 Allowed 'General case' 0 N--CA 1.48 1.073 0 O-C-N 119.928 -1.733 . . . . 10.0 115.105 -173.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.51 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 0.4 OUTLIER 40.15 95.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.294 2.238 . . . . 10.0 113.757 -159.87 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -163.17 -175.04 4.1 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.267 2.627 . . . . 10.0 109.066 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -44.18 -53.89 6.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.224 2.21 . . . . 10.0 113.124 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.97 19.67 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.303 2.241 . . . . 10.0 116.199 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.3 p -160.05 -45.73 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.364 1.465 . . . . 10.0 110.716 -165.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.74 -22.24 56.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.634 1.174 . . . . 10.0 111.835 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -60.42 3.62 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.571 -0.9 . . . . 10.0 108.571 165.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.2 -37.68 83.86 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 110.538 -0.171 . . . . 10.0 110.538 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -70.43 -51.71 27.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 118.018 -0.991 . . . . 10.0 113.258 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.43 -34.05 76.43 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.356 1.889 . . . . 10.0 113.236 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -72.86 -29.58 63.3 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.101 0.778 . . . . 10.0 113.101 174.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.28 72.43 2.25 Favored Pre-proline 0 CA--C 1.561 1.374 0 N-CA-C 113.695 0.998 . . . . 10.0 113.695 -173.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.39 -50.31 0.73 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.736 2.958 . . . . 10.0 112.887 -165.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.74 -36.11 71.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.64 1.976 . . . . 10.0 112.921 177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -30.29 58.1 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.587 1.555 . . . . 10.0 112.793 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -75.78 -52.92 9.36 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.865 1.061 . . . . 10.0 113.865 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.0 pt -128.93 139.77 36.66 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 118.558 0.617 . . . . 10.0 112.279 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.55 146.89 56.54 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.939 2.426 . . . . 10.0 111.874 -168.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.13 10.84 10.32 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.82 1.2 . . . . 10.0 115.717 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.405 ' HG1' ' CGD' ' A' ' 105' ' ' HEC . 0.5 OUTLIER -71.46 139.22 49.54 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.956 1.878 . . . . 10.0 110.4 175.768 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -84.8 -61.1 1.86 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 117.214 -1.374 . . . . 10.0 112.675 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.1 ttt 8.84 83.29 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 128.719 2.807 . . . . 10.0 114.098 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.24 74.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.307 1.443 . . . . 10.0 109.911 -171.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -163.15 -52.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.097 0.959 . . . . 10.0 112.911 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 40.15 82.82 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.261 2.225 . . . . 10.0 116.163 172.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.02 105.27 2.86 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.171 0.891 . . . . 10.0 111.781 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.2 tt -62.55 -50.86 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.864 -0.786 . . . . 10.0 112.494 -172.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.0 mttt 161.45 174.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 1 C-N-CA 132.291 4.236 . . . . 10.0 109.299 161.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 10.5 mmpt? 43.64 -98.59 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.962 2.505 . . . . 10.0 112.195 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.85 -49.0 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 129.681 3.192 . . . . 10.0 109.519 173.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 m -49.82 -46.66 51.36 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.736 2.014 . . . . 10.0 112.669 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -56.94 -35.97 69.71 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.108 0.963 . . . . 10.0 112.159 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -41.0 63.4 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.512 0.597 . . . . 10.0 111.032 175.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.04 -47.1 78.5 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 118.724 0.693 . . . . 10.0 111.997 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -57.14 -45.86 83.18 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.534 1.534 . . . . 10.0 111.818 174.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.02 -47.15 78.36 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 124.455 1.102 . . . . 10.0 113.364 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.5 mm -62.61 -46.06 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 118.355 -0.831 . . . . 10.0 109.145 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.05 82.52 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.966 0.803 . . . . 10.0 112.576 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.02 -63.19 1.17 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.281 1.032 . . . . 10.0 112.572 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.06 -37.63 80.42 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.787 0.835 . . . . 10.0 112.644 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -59.28 -16.94 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.126 0.97 . . . . 10.0 113.392 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -102.61 -45.04 5.16 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 117.529 -1.224 . . . . 10.0 113.725 160.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.58 62.77 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.57 1.692 . . . . 10.0 115.57 -173.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.8 p -72.37 -10.39 59.72 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.869 -1.144 . . . . 10.0 113.931 171.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -154.05 24.77 0.49 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.997 1.719 . . . . 10.0 111.938 -163.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . 0.253 5.4 pt-20 . . . . . 0 C--O 1.248 1.024 0 C-N-CA 126.387 1.875 . . . . 10.0 115.233 -159.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.51 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 110.433 -1.067 . . . . 10.0 110.433 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -150.31 169.72 20.71 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.351 1.46 . . . . 10.0 110.248 -177.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.7 t -58.11 -57.11 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.845 1.258 . . . . 10.0 109.803 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.456 ' OE2' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -62.85 -39.1 93.35 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.117 1.367 . . . . 10.0 113.995 179.255 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.65 -29.79 70.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.236 -0.888 . . . . 10.0 112.345 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -89.83 -43.21 5.17 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 124.92 1.248 . . . . 10.0 112.503 -170.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.456 ' HE2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.544 -0.974 . . . . 10.0 112.606 175.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -35.81 79.59 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.09 -0.957 . . . . 10.0 112.967 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.7 tp -78.2 -33.22 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.728 1.149 . . . . 10.0 110.889 176.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -57.07 -52.9 63.42 Favored 'General case' 0 C--N 1.342 0.263 0 O-C-N 121.224 -0.923 . . . . 10.0 110.437 166.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.4 t -65.8 -9.02 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 O-C-N 121.336 -0.853 . . . . 10.0 113.166 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.96 -37.79 10.05 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.662 1.585 . . . . 10.0 112.047 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptm -124.03 -14.08 7.17 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.817 1.414 . . . . 10.0 114.817 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.5 m -119.86 -39.89 2.8 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.772 1.629 . . . . 10.0 111.725 -172.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.96 -20.23 22.52 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 168.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.67 -21.05 2.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.692 1.997 . . . . 10.0 113.602 168.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.0 m -143.13 -28.83 0.55 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.555 1.542 . . . . 10.0 114.759 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.444 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 91.3 m-70 -103.49 -55.73 2.34 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.591 1.33 . . . . 10.0 114.591 -169.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m 35.11 84.35 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.593 2.757 . . . . 10.0 114.173 -168.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.63 -34.09 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.361 1.065 . . . . 10.0 112.545 164.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -95.1 154.8 17.0 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.921 0.711 . . . . 10.0 112.921 -156.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.8 mttp 50.98 -120.84 1.69 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.165 1.386 . . . . 10.0 110.485 176.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.13 62.49 3.34 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.549 1.071 . . . . 10.0 112.405 172.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.58 149.05 51.16 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.202 1.382 . . . . 10.0 114.908 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -162.19 105.36 1.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.859 1.664 . . . . 10.0 111.932 -164.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -67.8 70.19 0.13 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.848 2.059 . . . . 10.0 113.429 176.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.13 -38.95 69.14 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.427 1.491 . . . . 10.0 113.973 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.0 m -153.39 -9.69 0.16 Allowed 'General case' 0 N--CA 1.482 1.158 0 O-C-N 120.769 -1.207 . . . . 10.0 113.189 -171.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.444 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -129.15 172.05 19.81 Favored Glycine 0 CA--C 1.539 1.569 0 N-CA-C 109.525 -1.43 . . . . 10.0 109.525 152.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -71.65 163.58 38.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 120.286 2.043 . . . . 10.0 110.033 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.439 HD22 ' CD2' ' A' ' 33' ' ' HIS . 13.2 p30 -72.03 7.76 1.52 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.825 1.787 . . . . 10.0 115.825 -167.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mp 40.3 73.68 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.219 1.408 . . . . 10.0 111.587 -165.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.439 ' CD2' HD22 ' A' ' 31' ' ' ASN . 4.5 m80 -53.34 -164.51 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.894 2.878 . . . . 10.0 113.243 173.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.72 58.72 0.05 OUTLIER Glycine 0 CA--C 1.541 1.658 0 O-C-N 120.011 -1.681 . . . . 10.0 113.149 163.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tp -69.76 -38.47 76.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 128.679 2.792 . . . . 10.0 113.832 -161.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -66.21 95.95 0.32 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.457 1.503 . . . . 10.0 110.29 -175.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.72 13.85 9.99 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.225 1.393 . . . . 10.0 114.678 -173.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.6 ptm85 -150.64 -176.61 5.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.413 2.107 . . . . 10.0 114.74 -175.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -74.6 161.75 29.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.973 2.109 . . . . 10.0 113.837 -163.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.57 -34.74 25.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.56 1.944 . . . . 10.0 113.315 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.92 2.58 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 119.908 -1.745 . . . . 10.0 112.696 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.81 -5.01 1.05 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 118.057 2.614 . . . . 10.0 118.057 -168.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.92 113.75 27.86 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 125.807 1.643 . . . . 10.0 114.424 -167.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -79.22 57.25 6.39 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.552 3.501 . . . . 10.0 113.211 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.59 67.2 0.23 Allowed Glycine 0 N--CA 1.471 1.031 0 C-N-CA 124.527 1.061 . . . . 10.0 112.989 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -144.9 177.76 8.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.352 1.461 . . . . 10.0 109.255 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.2 t -152.77 123.85 7.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.271 1.028 . . . . 10.0 109.686 -177.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.19 172.48 18.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.492 1.517 . . . . 10.0 112.705 -159.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.4 p -74.81 107.12 6.7 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.541 -0.725 . . . . 10.0 110.902 177.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -75.21 83.35 2.38 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 122.489 1.138 . . . . 10.0 112.877 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -139.27 -46.21 0.46 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.096 1.758 . . . . 10.0 108.924 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -45.5 -67.04 0.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.373 2.269 . . . . 10.0 111.024 161.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.414 ' H ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -57.0 -49.33 76.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.265 0.939 . . . . 10.0 111.727 -178.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.69 -17.38 3.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.317 1.847 . . . . 10.0 115.012 173.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.16 60.08 0.29 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.345 0.975 . . . . 10.0 111.002 -169.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.06 -160.39 4.68 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.882 1.706 . . . . 10.0 115.527 173.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.3 pp -169.99 5.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 126.887 2.075 . . . . 10.0 112.698 -150.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.6 m 56.0 118.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.923 2.089 . . . . 10.0 113.645 -163.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.417 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 5.7 m95 -69.53 121.98 18.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.73 -1.231 . . . . 10.0 110.441 168.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -171.03 -179.05 2.63 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.349 1.859 . . . . 10.0 111.439 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -62.06 27.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 131.177 3.791 . . . . 10.0 115.46 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -160.07 9.28 0.1 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.254 2.222 . . . . 10.0 112.089 -167.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.2 p -157.71 -26.78 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.911 -1.118 . . . . 10.0 111.767 -165.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.8 -28.41 60.71 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 117.833 -1.079 . . . . 10.0 112.843 164.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -62.66 -54.3 41.5 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.684 1.129 . . . . 10.0 109.217 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 tp10 -64.07 -41.71 97.25 Favored 'General case' 0 N--CA 1.463 0.195 0 O-C-N 123.527 0.517 . . . . 10.0 110.017 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.64 -48.57 74.33 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.644 -0.693 . . . . 10.0 112.34 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -59.31 -53.96 52.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.288 1.403 . . . . 10.0 110.174 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.39 -18.63 63.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.883 1.438 . . . . 10.0 114.883 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.19 67.45 2.36 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 123.845 0.858 . . . . 10.0 111.803 -176.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.9 -63.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.576 2.851 . . . . 10.0 113.384 -164.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.56 -20.76 65.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.629 1.571 . . . . 10.0 113.473 -178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.88 -51.36 12.67 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.715 2.006 . . . . 10.0 111.275 168.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -60.35 -44.51 95.49 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.83 0.852 . . . . 10.0 112.767 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.34 133.59 20.65 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 124.005 0.922 . . . . 10.0 110.407 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.17 67.75 8.49 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.902 3.068 . . . . 10.0 113.9 -158.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -179.21 -115.31 0.46 Allowed Glycine 0 CA--C 1.524 0.617 0 C-N-CA 124.919 1.247 . . . . 10.0 110.037 167.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.254 36.9 m 67.85 155.89 0.11 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 128.989 2.915 . . . . 10.0 115.013 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mmtt -140.68 19.64 2.35 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.117 1.767 . . . . 10.0 112.601 -175.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.7 ttt -67.78 79.95 0.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.558 1.543 . . . . 10.0 111.398 166.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 71.7 mt -71.14 78.1 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 124.88 1.272 . . . . 10.0 109.87 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -164.09 -40.55 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.022 2.529 . . . . 10.0 110.501 170.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.98 -128.69 1.31 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.299 1.44 . . . . 10.0 112.945 -167.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.59 162.89 53.49 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-O 122.271 0.928 . . . . 10.0 115.131 -162.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.5 tp -80.83 3.91 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 113.757 1.021 . . . . 10.0 113.757 -168.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 62.4 0.65 0.63 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.571 2.348 . . . . 10.0 115.695 172.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -160.37 -144.97 0.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 129.983 3.313 . . . . 10.0 106.847 -163.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.64 -31.73 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 122.953 2.615 . . . . 10.0 117.888 -176.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -61.8 -34.52 76.06 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 121.604 2.002 . . . . 10.0 110.931 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 90' ' ' GLU . 1.4 pm0 -75.31 -4.43 39.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.914 2.485 . . . . 10.0 114.731 170.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.414 ' HA ' ' CZ ' ' A' ' 91' ' ' ARG . 1.4 tpm_? -72.45 -58.25 3.54 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 120.77 -1.206 . . . . 10.0 109.852 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -75.57 -29.7 59.42 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 117.076 -1.44 . . . . 10.0 114.29 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 9.6 p30 -65.06 -42.19 94.45 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.789 2.086 . . . . 10.0 112.7 177.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -55.54 -48.27 74.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.753 1.621 . . . . 10.0 112.532 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.7 mm -61.6 -48.1 90.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 118.872 -0.585 . . . . 10.0 109.642 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.3 91.07 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.638 0.775 . . . . 10.0 112.099 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -60.71 -61.93 2.23 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.846 1.258 . . . . 10.0 111.745 173.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.58 -39.73 94.64 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 118.131 -0.938 . . . . 10.0 112.029 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -16.14 63.2 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.694 1.133 . . . . 10.0 113.352 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -89.2 -58.43 2.54 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 124.24 1.016 . . . . 10.0 109.524 162.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.31 -19.1 32.18 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 115.776 1.769 . . . . 10.0 115.776 -173.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 p -65.71 -11.27 43.87 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.35 1.46 . . . . 10.0 114.589 167.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.98 -15.5 0.14 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.198 1.799 . . . . 10.0 115.028 -168.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 . . . . . 0 C--O 1.244 0.81 0 C-N-CA 126.389 1.875 . . . . 10.0 111.523 -170.132 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.417 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.988 0 CA-C-O 118.953 -0.915 . . . . 10.0 113.456 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.443 ' HB2' ' HE3' ' A' ' 5' ' ' LYS . 4.7 m-20 -135.34 139.96 44.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.651 1.58 . . . . 10.0 110.778 178.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.6 p -62.98 -43.66 99.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 -172.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.0 mp0 -61.74 -53.01 61.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.904 0.882 . . . . 10.0 110.795 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.443 ' HE3' ' HB2' ' A' ' 2' ' ' ASP . 4.3 mtmp? -60.88 -20.88 62.67 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.922 1.082 . . . . 10.0 113.922 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -91.58 -38.03 5.98 Favored Glycine 0 C--N 1.337 0.62 0 CA-C-N 119.129 0.877 . . . . 10.0 112.647 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -28.51 65.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.103 1.452 . . . . 10.0 112.473 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HZ1' ' CD ' ' A' ' 90' ' ' GLU . 1.6 pttm -60.92 -50.69 72.39 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.826 0.739 . . . . 10.0 111.629 172.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -67.11 -37.16 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 118.515 0.598 . . . . 10.0 110.864 178.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.429 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.8 t80 -55.7 -52.0 65.39 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-N 118.082 0.401 . . . . 10.0 110.541 170.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.4 t -65.95 -11.67 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -95.34 -32.47 12.94 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.89 1.276 . . . . 10.0 112.638 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -122.12 -56.98 1.8 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.883 1.273 . . . . 10.0 111.333 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.429 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 12.6 m -67.1 -51.52 53.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.864 1.666 . . . . 10.0 112.6 -171.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.46 -11.03 39.2 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 -172.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.57 -56.42 21.52 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.17 1.388 . . . . 10.0 109.531 166.196 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.3 m -85.25 -37.43 20.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.02 1.328 . . . . 10.0 112.556 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -120.82 44.89 2.37 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 127.079 2.152 . . . . 10.0 112.973 -163.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -57.86 125.19 21.98 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 119.872 -1.768 . . . . 10.0 111.537 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.78 -38.24 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-O 117.248 -1.358 . . . . 10.0 114.518 -168.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -11.84 37.81 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 121.46 1.936 . . . . 10.0 114.605 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -152.02 152.01 31.89 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 128.221 2.608 . . . . 10.0 107.944 167.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.25 -67.08 0.93 Allowed Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.07 1.319 . . . . 10.0 114.504 177.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.02 119.58 1.48 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 124.597 1.094 . . . . 10.0 111.68 -170.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -159.54 166.47 30.75 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.211 1.805 . . . . 10.0 110.233 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -152.7 125.65 8.48 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.523 1.129 . . . . 10.0 112.53 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -144.01 120.0 10.68 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.993 2.117 . . . . 10.0 108.407 176.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.6 m 56.85 -31.41 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.217 1.807 . . . . 10.0 115.56 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.49 159.0 19.99 Favored Glycine 0 CA--C 1.545 1.914 0 CA-C-N 120.941 1.7 . . . . 10.0 112.199 164.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.73 168.87 23.38 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 125.079 3.852 . . . . 10.0 113.537 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.51 123.41 19.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.63 -1.294 . . . . 10.0 108.336 162.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.74 93.27 0.1 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.303 1.041 . . . . 10.0 109.096 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -170.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.261 3.024 . . . . 10.0 113.448 -178.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.89 53.34 0.1 OUTLIER Glycine 0 CA--C 1.541 1.698 0 C-N-CA 126.424 1.964 . . . . 10.0 114.816 172.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mp -68.63 177.58 2.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 129.594 3.158 . . . . 10.0 112.931 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 64.18 59.7 1.03 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.232 1.813 . . . . 10.0 110.504 -166.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.17 16.84 0.26 Allowed Glycine 0 CA--C 1.535 1.283 0 N-CA-C 116.725 1.45 . . . . 10.0 116.725 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.0 ptm85 -152.88 168.78 24.64 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.326 2.063 . . . . 10.0 112.969 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.75 173.86 11.16 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.472 1.909 . . . . 10.0 113.554 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 77.6 p -69.65 172.57 7.24 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.583 1.953 . . . . 10.0 111.541 159.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.35 51.24 4.45 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.201 -0.937 . . . . 10.0 114.603 171.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -11.22 2.85 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.601 1.334 . . . . 10.0 114.601 -164.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.62 140.77 92.3 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 123.35 0.66 . . . . 10.0 112.036 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.03 63.38 8.74 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.558 2.838 . . . . 10.0 112.24 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.24 64.54 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.371 0.986 . . . . 10.0 114.978 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -67.32 170.36 7.38 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 118.424 1.112 . . . . 10.0 112.115 170.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.4 t -152.72 138.35 17.81 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.075 -1.015 . . . . 10.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 -96.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.464 1.506 . . . . 10.0 111.378 -154.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.2 p -142.24 136.89 30.29 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.599 1.559 . . . . 10.0 109.74 167.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.45 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -74.75 -31.05 61.69 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.087 -0.506 . . . . 10.0 112.339 177.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.26 -29.83 70.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.505 1.922 . . . . 10.0 113.299 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -72.8 -74.77 0.16 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.48 0.712 . . . . 10.0 109.542 160.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HZ3' ' CG ' ' A' ' 50' ' ' ASP 0.307 0.0 OUTLIER -60.24 -31.64 70.39 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.324 1.601 . . . . 10.0 115.324 -157.133 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.37 -22.89 65.55 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.876 1.435 . . . . 10.0 114.876 173.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.67 -36.29 83.22 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.582 1.083 . . . . 10.0 110.797 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.75 13.49 69.68 Favored Glycine 0 CA--C 1.533 1.165 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 165.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.4 pt -51.61 140.47 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 125.931 1.692 . . . . 10.0 111.85 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.1 m -76.13 108.53 9.11 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.418 0.628 . . . . 10.0 109.783 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -69.98 114.89 8.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.947 0.899 . . . . 10.0 111.33 173.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -163.85 -174.53 3.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.316 3.046 . . . . 10.0 109.294 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.22 -54.36 44.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.215 -0.928 . . . . 10.0 111.849 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -62.88 20.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.982 2.913 . . . . 10.0 115.467 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.4 p -158.37 -36.84 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.463 1.905 . . . . 10.0 111.228 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mp -73.92 -30.76 62.74 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 121.051 1.75 . . . . 10.0 112.642 166.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.1 ttm -64.27 -52.62 57.76 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.559 0.618 . . . . 10.0 109.487 175.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.65 -38.41 91.01 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.339 0.656 . . . . 10.0 110.647 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -64.21 -61.9 1.96 Allowed 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.451 -0.785 . . . . 10.0 112.323 175.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.0 tp -66.49 -30.11 70.37 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 120.323 1.42 . . . . 10.0 113.42 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -68.93 -24.49 64.29 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 119.01 0.823 . . . . 10.0 112.809 172.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.25 77.94 2.02 Favored Pre-proline 0 CA--C 1.556 1.208 0 N-CA-C 114.609 1.337 . . . . 10.0 114.609 172.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.79 -41.43 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 121.883 1.722 . . . . 10.0 112.143 -166.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.438 ' HE2' ' CB ' ' A' ' 83' ' ' ALA . 33.3 mttm -67.58 23.28 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.318 2.647 . . . . 10.0 114.777 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.4 mttm -161.36 -31.97 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.555 2.342 . . . . 10.0 111.932 -170.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -68.51 -31.63 71.02 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.276 0.944 . . . . 10.0 113.321 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 pt -135.81 151.84 74.82 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.889 1.276 . . . . 10.0 110.808 177.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.98 22.17 0.49 Allowed 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.29 3.326 . . . . 10.0 115.91 -159.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.4 100.47 0.17 Allowed Glycine 0 CA--C 1.524 0.638 0 O-C-N 121.206 -0.934 . . . . 10.0 112.663 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.32 -27.53 2.42 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.066 1.506 . . . . 10.0 115.066 -172.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.63 -70.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 116.566 -1.683 . . . . 10.0 112.831 -170.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.6 ttt 23.3 92.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 129.535 3.134 . . . . 10.0 113.914 -176.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.8 mt -70.31 70.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 125.741 1.616 . . . . 10.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -162.76 -70.16 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.458 1.903 . . . . 10.0 110.445 169.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.438 ' CB ' ' HE2' ' A' ' 72' ' ' LYS . . . 45.51 87.09 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.72 2.408 . . . . 10.0 116.732 171.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.65 93.63 2.26 Favored Glycine 0 C--N 1.341 0.843 0 C-N-CA 124.472 1.034 . . . . 10.0 111.181 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -66.54 156.24 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 122.34 1.067 . . . . 10.0 113.166 -175.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -59.98 -20.92 60.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.142 2.177 . . . . 10.0 115.356 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -161.51 133.84 5.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.998 2.119 . . . . 10.0 109.392 -165.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.75 -57.33 13.39 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.113 0.965 . . . . 10.0 112.79 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.4 m -50.72 -43.8 57.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.004 1.321 . . . . 10.0 112.278 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.47 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 60.0 mm-40 -59.41 -34.74 72.84 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.394 1.078 . . . . 10.0 112.734 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.3 ttp-105 -70.49 -34.19 72.09 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.127 1.33 . . . . 10.0 112.545 172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.35 -46.8 72.32 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 174.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.424 ' CG ' ' HZ1' ' A' ' 5' ' ' LYS . 68.1 m-20 -56.57 -52.12 66.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.602 1.561 . . . . 10.0 113.408 171.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 23.3 tp -53.12 -49.44 66.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.714 1.605 . . . . 10.0 113.521 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 12.1 mt -62.12 -39.28 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-O 119.176 -0.44 . . . . 10.0 110.685 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.44 87.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.562 0.619 . . . . 10.0 112.6 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -56.22 -56.3 22.62 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 117.841 -1.076 . . . . 10.0 111.281 169.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.14 -34.46 78.44 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 120.029 1.286 . . . . 10.0 112.37 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -59.42 -25.52 64.39 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 171.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -93.75 -62.06 1.43 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.741 1.616 . . . . 10.0 112.057 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.96 -11.17 12.03 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.803 1.779 . . . . 10.0 115.803 -164.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 p -81.27 -6.6 59.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -153.56 -10.45 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.187 1.795 . . . . 10.0 114.999 -169.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.249 1.046 0 C-N-CA 127.798 2.439 . . . . 10.0 110.725 -177.413 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 119.46 -0.633 . . . . 10.0 112.002 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -136.65 132.11 34.56 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.118 0.967 . . . . 10.0 111.159 -157.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.48 -54.96 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 125.428 1.491 . . . . 10.0 111.422 -167.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.22 -27.63 66.53 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 115.565 1.691 . . . . 10.0 115.565 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -64.23 -42.6 96.49 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.337 0.517 . . . . 10.0 109.611 163.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.56 -41.98 49.34 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 124.348 0.975 . . . . 10.0 111.377 -170.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -45.17 -59.62 2.54 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 126.987 2.115 . . . . 10.0 111.287 173.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -71.89 -42.3 66.95 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.314 1.046 . . . . 10.0 112.085 -172.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.84 -37.46 79.93 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 118.767 0.712 . . . . 10.0 111.351 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -56.02 -52.24 64.93 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 119.107 0.867 . . . . 10.0 110.107 167.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.5 t -61.36 -14.33 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -92.52 -38.51 11.89 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.472 1.509 . . . . 10.0 112.169 -177.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -130.23 0.09 4.61 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.769 1.766 . . . . 10.0 115.769 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.1 m -131.8 -43.48 0.99 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.241 1.417 . . . . 10.0 112.592 -176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.52 67.4 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.135 -0.978 . . . . 10.0 112.821 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -1.57 0.24 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.542 2.337 . . . . 10.0 114.791 170.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.3 m -143.16 -33.16 0.45 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.004 2.122 . . . . 10.0 112.468 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -115.25 -10.21 12.13 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.018 1.727 . . . . 10.0 115.271 -174.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 p 57.6 -68.17 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 128.661 2.784 . . . . 10.0 117.487 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.3 t 39.22 -96.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 128.954 2.902 . . . . 10.0 112.33 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -65.74 -17.46 64.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.472 1.109 . . . . 10.0 112.605 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -80.39 59.53 3.49 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.604 -1.31 . . . . 10.0 110.974 166.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.75 -58.78 3.01 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.1 1.81 . . . . 10.0 114.633 173.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.74 116.94 2.07 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 124.369 0.985 . . . . 10.0 113.704 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -163.55 172.83 13.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 128.74 2.816 . . . . 10.0 109.196 177.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -152.74 67.68 0.82 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.875 0.87 . . . . 10.0 110.977 -165.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.7 mtpt -96.05 -78.73 0.46 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.808 1.243 . . . . 10.0 111.884 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -81.11 -25.75 36.73 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.373 0.508 . . . . 10.0 112.373 -175.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -132.8 173.86 20.74 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 125.583 1.563 . . . . 10.0 110.286 162.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.477 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 84.8 Cg_endo -72.21 161.22 45.17 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.36 2.04 . . . . 10.0 110.609 172.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.96 125.08 23.78 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.985 -1.072 . . . . 10.0 109.711 166.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -77.34 74.76 3.9 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 163.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -170.83 0.14 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 10.0 109.503 158.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -32.45 114.44 0.08 OUTLIER Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.13 0.871 . . . . 10.0 112.421 163.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 tp -136.56 -46.79 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.462 1.505 . . . . 10.0 112.054 -174.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -71.0 109.58 5.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.434 0.693 . . . . 10.0 109.953 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.25 4.29 90.25 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 118.661 -1.077 . . . . 10.0 113.865 -174.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mtp85 -81.45 -97.28 0.04 OUTLIER 'General case' 0 C--N 1.347 0.478 0 CA-C-O 116.946 -1.502 . . . . 10.0 109.087 169.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -152.42 -119.95 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 120.578 1.536 . . . . 10.0 110.744 174.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.6 m -148.7 165.85 30.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.468 3.107 . . . . 10.0 106.967 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 68.46 -3.58 5.95 Favored Glycine 0 CA--C 1.529 0.917 0 N-CA-C 118.763 2.265 . . . . 10.0 118.763 156.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.23 125.38 26.5 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.603 1.961 . . . . 10.0 111.236 174.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.71 157.38 16.33 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.88 1.672 . . . . 10.0 108.732 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -83.84 -119.24 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 124.005 3.137 . . . . 10.0 109.897 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.99 74.8 0.95 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.915 1.245 . . . . 10.0 113.084 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.477 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 51.0 t80 -144.56 107.24 4.43 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.019 1.327 . . . . 10.0 111.791 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.5 m -79.77 95.32 5.96 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.773 1.229 . . . . 10.0 111.539 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.05 173.19 11.32 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.356 0.872 . . . . 10.0 113.356 169.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.4 p -69.31 -5.05 20.66 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 128.66 2.784 . . . . 10.0 115.616 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 t70 47.42 -169.46 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.384 1.874 . . . . 10.0 114.046 -159.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.23 -42.82 0.1 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.374 3.07 . . . . 10.0 115.307 -166.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -61.29 2.72 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.838 1.255 . . . . 10.0 111.079 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -43.23 55.18 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 127.315 2.246 . . . . 10.0 112.375 168.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -18.22 65.19 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 115.447 1.647 . . . . 10.0 115.447 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.96 -32.29 61.68 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.093 0.86 . . . . 10.0 111.174 170.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.17 28.43 73.68 Favored Glycine 0 CA--C 1.537 1.466 0 N-CA-C 116.277 1.271 . . . . 10.0 116.277 162.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -7.55 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 127.343 2.257 . . . . 10.0 116.584 -173.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.4 m 57.62 108.47 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.695 2.398 . . . . 10.0 114.384 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -66.62 135.07 53.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.18 1.392 . . . . 10.0 110.624 172.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 163.23 -72.5 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 129.875 3.27 . . . . 10.0 107.692 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -44.82 -61.77 1.47 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.548 1.939 . . . . 10.0 111.477 -178.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 2.3 p -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 127.611 2.364 . . . . 10.0 112.22 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -32.92 60.23 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.105 0.962 . . . . 10.0 113.449 177.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 6.8 ttm -62.83 -52.9 61.35 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 170.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -64.97 -38.19 90.15 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.226 1.41 . . . . 10.0 111.025 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -60.83 -64.09 1.08 Allowed 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.208 1.003 . . . . 10.0 110.716 170.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.72 -32.15 68.94 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.611 1.096 . . . . 10.0 112.67 -175.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.4 -35.33 69.89 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.669 1.359 . . . . 10.0 114.669 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -162.39 80.49 1.81 Allowed Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 119.811 1.187 . . . . 10.0 111.543 173.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.7 -44.68 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.413 2.076 . . . . 10.0 112.174 -160.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -60.14 -34.78 74.02 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 127.209 2.204 . . . . 10.0 113.359 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -76.3 -41.41 48.71 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 119.061 -0.495 . . . . 10.0 111.489 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -69.88 -39.25 76.4 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.649 1.351 . . . . 10.0 114.649 -171.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 21.0 pt -135.17 144.02 48.25 Favored Pre-proline 0 N--CA 1.473 0.696 0 CA-C-N 118.811 0.732 . . . . 10.0 111.458 172.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -69.3 163.87 36.28 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.192 2.594 . . . . 10.0 111.083 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.15 -22.82 0.16 Allowed Glycine 0 CA--C 1.535 1.323 0 N-CA-C 116.344 1.298 . . . . 10.0 116.344 176.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.73 118.63 5.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 120.053 1.926 . . . . 10.0 109.745 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -87.12 -71.08 0.58 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.871 0.868 . . . . 10.0 110.683 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.4 ttp 28.61 101.17 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 129.892 3.277 . . . . 10.0 113.987 -176.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.6 tp -64.2 54.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 128.871 2.868 . . . . 10.0 114.407 -174.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -163.4 -176.08 4.56 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.542 2.337 . . . . 10.0 110.697 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.51 -155.82 0.34 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.867 2.467 . . . . 10.0 109.763 -173.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.68 44.06 0.15 Allowed Glycine 0 CA--C 1.536 1.354 0 C-N-CA 128.193 2.806 . . . . 10.0 117.656 -170.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.429 HG23 ' H ' ' A' ' 86' ' ' LYS 0.368 7.4 tt 42.96 -112.19 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 128.833 2.853 . . . . 10.0 113.036 -177.45 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.429 ' H ' HG23 ' A' ' 85' ' ' ILE . 53.9 tttm -149.7 -69.65 0.2 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.157 1.799 . . . . 10.0 113.259 173.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.74 148.04 36.96 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.486 1.039 . . . . 10.0 110.684 173.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -58.55 -36.84 74.52 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.11 -0.369 . . . . 10.0 111.619 169.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 m -55.94 -53.81 52.3 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 124.774 1.23 . . . . 10.0 110.062 176.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -57.76 -39.4 77.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.832 0.853 . . . . 10.0 111.771 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -50.51 73.76 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 118.764 -0.636 . . . . 10.0 111.709 175.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -58.19 -52.63 64.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.392 1.077 . . . . 10.0 111.539 172.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -55.81 -47.78 76.56 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 126.841 2.056 . . . . 10.0 111.465 -170.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.56 -43.8 93.48 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.4 mm -65.45 -44.26 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 118.948 -0.549 . . . . 10.0 110.528 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.38 85.74 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.649 0.779 . . . . 10.0 112.163 175.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -57.21 -55.07 39.54 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.061 1.344 . . . . 10.0 111.443 171.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.29 -34.7 78.25 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 118.436 -0.792 . . . . 10.0 112.618 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -59.98 -20.79 59.54 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.941 1.296 . . . . 10.0 113.462 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -92.87 -50.68 5.44 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.73 1.212 . . . . 10.0 112.196 165.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.04 -22.85 63.17 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 120.21 1.368 . . . . 10.0 114.567 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.6 t -76.55 6.4 5.89 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.586 1.954 . . . . 10.0 114.489 169.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -151.37 -42.35 0.12 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.855 1.662 . . . . 10.0 113.685 -166.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 115.987 -1.959 . . . . 10.0 115.224 -179.184 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.608 -1.106 . . . . 10.0 113.51 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -118.12 154.5 32.02 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.776 1.63 . . . . 10.0 112.143 166.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.92 -52.15 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.21 1.404 . . . . 10.0 111.886 171.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -47.36 71.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 124.277 1.031 . . . . 10.0 113.469 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.58 -15.66 58.72 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.961 0.8 . . . . 10.0 112.204 172.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.21 -48.96 3.4 Favored Glycine 0 C--N 1.34 0.773 0 C-N-CA 125.224 1.393 . . . . 10.0 112.318 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -35.12 79.6 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 122.264 -0.55 . . . . 10.0 112.478 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -39.18 90.01 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.441 0.904 . . . . 10.0 113.441 174.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -33.89 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.615 1.098 . . . . 10.0 111.079 175.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -55.98 -52.07 65.49 Favored 'General case' 0 C--N 1.342 0.244 0 O-C-N 121.435 -0.791 . . . . 10.0 110.454 167.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.9 t -63.67 -11.41 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 113.632 0.975 . . . . 10.0 113.632 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -85.32 -48.0 9.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.271 1.028 . . . . 10.0 111.337 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -136.07 4.85 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 -168.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.5 m -116.74 -41.6 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.439 1.496 . . . . 10.0 111.215 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.64 -27.07 57.66 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.538 0.94 . . . . 10.0 113.538 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -55.34 -15.21 2.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.882 2.073 . . . . 10.0 115.571 172.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 69.4 m -142.09 -14.32 0.8 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.237 1.415 . . . . 10.0 112.673 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -128.44 -13.45 4.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.845 1.424 . . . . 10.0 114.845 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.3 t 39.46 11.62 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 120.352 3.464 . . . . 10.0 120.352 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.0 p -63.82 -16.02 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 N-CA-C 117.053 2.242 . . . . 10.0 117.053 -160.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.03 6.83 4.71 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.251 1.387 . . . . 10.0 112.443 169.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -152.02 -173.26 4.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.188 2.995 . . . . 10.0 107.941 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.63 134.18 39.06 Favored Glycine 0 CA--C 1.533 1.168 0 O-C-N 121.057 -1.027 . . . . 10.0 112.113 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.05 54.12 3.83 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.502 1.525 . . . . 10.0 116.888 -168.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HB2' ' HE2' ' A' ' 25' ' ' LYS . 1.4 mppt? -62.2 91.28 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.506 1.123 . . . . 10.0 110.566 170.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -69.17 66.14 0.16 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.983 1.313 . . . . 10.0 112.523 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -95.05 116.98 29.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.69 1.596 . . . . 10.0 108.097 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 m 57.68 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 127.428 2.291 . . . . 10.0 116.568 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -134.68 148.46 19.53 Favored Glycine 0 CA--C 1.547 2.065 0 CA-C-N 121.902 2.137 . . . . 10.0 113.724 165.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -82.27 68.08 7.89 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.064 3.176 . . . . 10.0 112.395 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.446 HD22 ' CD2' ' A' ' 33' ' ' HIS . 11.6 p30 47.73 -11.46 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.495 1 N-CA-C 122.121 4.119 . . . . 10.0 122.121 157.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . 0.315 5.0 mp 55.28 37.37 28.8 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 128.755 2.822 . . . . 10.0 117.158 -175.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.446 ' CD2' HD22 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -52.67 108.22 0.29 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.945 1.698 . . . . 10.0 113.954 164.103 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.27 35.17 49.42 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 116.187 1.235 . . . . 10.0 116.187 158.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.78 -175.85 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 126.505 1.922 . . . . 10.0 111.696 168.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 60.39 64.97 1.12 Allowed 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.336 -1.478 . . . . 10.0 112.855 -173.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.59 -35.28 2.51 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.591 2.043 . . . . 10.0 112.886 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.477 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -66.79 154.41 40.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.335 1.054 . . . . 10.0 110.488 169.469 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -62.87 177.97 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.875 1.67 . . . . 10.0 111.963 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.71 156.17 31.25 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.12 -0.988 . . . . 10.0 109.731 158.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 43' ' ' ALA . . . 78.44 -116.21 4.35 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.249 -0.907 . . . . 10.0 112.926 169.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 54.64 -7.38 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.268 2.227 . . . . 10.0 116.766 -172.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 41' ' ' GLY . . . -57.42 158.59 10.51 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.327 2.651 . . . . 10.0 113.349 176.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.53 -175.25 1.04 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.144 2.562 . . . . 10.0 111.002 161.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.99 28.36 0.07 OUTLIER Glycine 0 CA--C 1.541 1.688 0 C-N-CA 127.492 2.472 . . . . 10.0 118.015 -173.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.27 128.06 34.16 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.917 1.687 . . . . 10.0 109.707 166.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 m -73.46 125.04 27.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.175 0.99 . . . . 10.0 112.489 -174.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.431 ' HB2' ' HZ1' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -140.08 178.15 7.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.536 1.934 . . . . 10.0 112.572 -175.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.0 p -85.93 106.24 16.98 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.169 0.895 . . . . 10.0 110.856 166.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -56.29 -29.49 61.25 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.863 1.801 . . . . 10.0 115.863 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.82 -54.94 31.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.87 1.268 . . . . 10.0 112.094 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -47.27 -55.98 7.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.746 1.618 . . . . 10.0 111.82 174.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.58 ' HZ2' ' CGD' ' A' ' 105' ' ' HEC . 0.2 OUTLIER -57.0 -57.25 13.35 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.571 0.748 . . . . 10.0 110.924 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -65.6 -22.74 66.7 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.489 0.922 . . . . 10.0 113.489 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -20.99 66.38 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.135 0.88 . . . . 10.0 112.858 171.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.06 11.58 63.89 Favored Glycine 0 CA--C 1.535 1.336 0 N-CA-C 116.076 1.191 . . . . 10.0 116.076 164.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.28 -6.29 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 128.643 2.777 . . . . 10.0 117.236 -171.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 84.9 m 58.38 117.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.65 2.78 . . . . 10.0 115.665 171.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.551 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 21.6 m95 -76.0 120.73 21.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.861 -1.063 . . . . 10.0 112.644 -175.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.37 179.21 5.12 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.262 2.225 . . . . 10.0 110.605 -176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' CD ' ' HZ1' ' A' ' 99' ' ' LYS . 2.7 tt0 -69.75 -13.24 62.18 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.248 1.419 . . . . 10.0 114.754 -169.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.02 -58.61 3.18 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.505 1.145 . . . . 10.0 111.406 163.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.6 p -75.19 -37.32 61.25 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.728 1.611 . . . . 10.0 112.882 -165.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.02 -11.71 59.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.965 1.306 . . . . 10.0 113.938 172.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -65.95 0.61 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 106.878 -1.527 . . . . 10.0 106.878 158.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -45.53 70.56 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.431 1.092 . . . . 10.0 111.332 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -66.64 -56.05 12.46 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.463 0.912 . . . . 10.0 113.463 -177.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -27.5 65.62 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.584 1.538 . . . . 10.0 112.36 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -66.55 -38.06 86.31 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 120.197 1.362 . . . . 10.0 114.227 169.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -162.81 100.13 1.06 Allowed Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 119.885 1.221 . . . . 10.0 111.672 166.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.69 -46.48 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.271 1.981 . . . . 10.0 111.493 -168.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -70.03 -22.36 63.1 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.224 1.81 . . . . 10.0 113.293 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -72.44 -53.93 10.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.716 0.806 . . . . 10.0 110.43 163.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -58.99 -41.0 86.54 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.42 155.27 64.28 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 124.228 1.011 . . . . 10.0 111.852 170.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.36 150.6 52.78 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.56 2.173 . . . . 10.0 113.193 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.87 -100.44 2.52 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.089 2.28 . . . . 10.0 111.208 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.289 96.9 m 34.65 90.43 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 130.731 3.612 . . . . 10.0 116.058 -176.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -73.31 19.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.853 1.427 . . . . 10.0 114.853 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.5 ttt -70.29 78.16 0.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.158 -0.964 . . . . 10.0 108.932 164.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 25.9 mm -69.51 78.56 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 125.0 1.32 . . . . 10.0 109.654 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -162.73 -72.42 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.52 1.128 . . . . 10.0 111.935 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -70.6 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.268 2.627 . . . . 10.0 116.439 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.17 86.78 0.11 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 126.621 2.058 . . . . 10.0 113.828 -166.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 tt -63.28 -53.99 38.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 115.108 1.521 . . . . 10.0 115.108 -163.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 163.58 -169.8 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 1 C-N-CA 131.821 4.049 . . . . 10.0 109.138 -175.742 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.409 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.64 -70.21 0.11 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.924 2.489 . . . . 10.0 114.207 -162.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.71 -51.5 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.502 1.297 . . . . 10.0 114.502 -173.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -46.87 88.26 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.439 1.018 . . . . 10.0 110.525 -175.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -60.27 -33.71 72.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.937 1.695 . . . . 10.0 112.179 -172.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.9 -43.94 97.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.009 2.124 . . . . 10.0 112.476 172.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.71 -43.44 65.9 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.896 1.278 . . . . 10.0 110.565 174.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -58.24 -44.09 88.13 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.689 1.196 . . . . 10.0 110.376 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.61 -47.63 66.85 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.229 1.196 . . . . 10.0 114.229 171.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.94 -47.22 89.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.62 82.16 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.648 0.779 . . . . 10.0 112.319 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -65.01 -63.23 1.16 Allowed 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.611 1.164 . . . . 10.0 112.017 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.43 -33.27 75.56 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.262 -0.875 . . . . 10.0 112.419 -170.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.402 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 15.8 tptm -62.55 -14.48 42.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.642 1.177 . . . . 10.0 113.311 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -95.29 -58.95 2.0 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.421 1.089 . . . . 10.0 110.952 161.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.81 -16.63 17.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 116.429 2.011 . . . . 10.0 116.429 -168.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.5 p -74.96 -4.54 38.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.844 1.424 . . . . 10.0 114.844 168.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -153.32 -22.24 0.15 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.062 1.745 . . . . 10.0 114.465 -167.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 C--O 1.249 1.035 0 C-N-CA 126.872 2.069 . . . . 10.0 111.059 -160.933 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.58 ' CGD' ' HZ2' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.667 0 CA-C-O 118.924 -0.931 . . . . 10.0 112.326 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.07 140.93 36.22 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.087 0.944 . . . . 10.0 112.816 -149.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -55.35 -50.05 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.837 2.055 . . . . 10.0 113.223 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mp0 -64.44 -32.94 74.77 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.373 -0.829 . . . . 10.0 111.639 -174.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -76.02 -12.38 60.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.031 1.732 . . . . 10.0 112.842 172.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.75 -48.01 3.53 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 124.21 0.91 . . . . 10.0 111.269 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -49.98 -44.34 50.79 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.161 0.98 . . . . 10.0 112.831 174.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.402 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -67.26 -12.86 61.21 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.883 1.673 . . . . 10.0 114.328 -177.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.402 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 8.1 tp -114.78 -28.03 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.689 0.796 . . . . 10.0 112.204 174.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -55.58 -52.91 62.17 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.224 1.01 . . . . 10.0 110.456 163.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.33 -12.8 9.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.936 0.717 . . . . 10.0 112.936 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.25 -70.23 0.72 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.919 1.288 . . . . 10.0 109.43 172.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -80.48 -11.14 59.71 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.228 1.566 . . . . 10.0 115.228 -168.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 m -124.46 -48.13 1.83 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.649 1.179 . . . . 10.0 111.735 -171.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.31 -13.2 57.94 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.658 0.985 . . . . 10.0 113.658 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -55.35 -14.15 1.74 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.858 1.663 . . . . 10.0 114.143 162.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.3 m -142.74 -25.03 0.63 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.803 2.041 . . . . 10.0 113.134 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.41 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 81.9 m-70 -126.74 77.17 1.7 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 127.145 2.178 . . . . 10.0 112.154 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 t -75.17 46.52 0.32 Allowed 'General case' 0 CA--C 1.557 1.249 0 O-C-N 120.182 -1.574 . . . . 10.0 114.494 -175.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.72 -51.46 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.802 1.641 . . . . 10.0 113.218 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -53.42 -45.26 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.719 1.208 . . . . 10.0 111.52 -171.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -86.17 7.24 25.8 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.63 1.572 . . . . 10.0 113.198 -176.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 23.02 78.15 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.535 1.064 . . . . 10.0 114.521 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.75 169.54 48.9 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.885 1.342 . . . . 10.0 112.462 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -70.82 153.64 42.56 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.364 0.602 . . . . 10.0 111.107 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.65 135.47 54.13 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.609 156.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -144.39 -76.55 0.23 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.611 1.164 . . . . 10.0 110.776 -175.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.1 m -76.35 -55.99 5.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.634 0.774 . . . . 10.0 110.039 169.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.72 167.36 16.32 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 123.835 0.731 . . . . 10.0 111.904 169.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 45.7 Cg_endo -68.3 166.3 25.81 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.27 3.313 . . . . 10.0 110.921 169.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -85.19 139.97 31.26 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.664 -1.235 . . . . 10.0 107.664 164.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.7 74.8 5.22 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.587 -0.894 . . . . 10.0 108.587 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 73.66 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.557 3.143 . . . . 10.0 113.159 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.27 -68.73 0.06 OUTLIER Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.506 2.479 . . . . 10.0 111.443 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.406 ' C ' HH11 ' A' ' 38' ' ' ARG 0.288 6.9 tp 112.06 -122.79 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.483 1 C-N-CA 132.529 4.331 . . . . 10.0 109.322 167.002 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 32.72 64.81 0.25 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.731 2.412 . . . . 10.0 116.731 167.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.25 -42.24 1.73 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.915 2.198 . . . . 10.0 115.023 172.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.406 HH11 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -64.62 11.0 0.06 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 120.363 3.468 . . . . 10.0 120.363 -158.567 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.9 mttt 79.03 147.2 0.09 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.527 3.131 . . . . 10.0 113.379 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -71.78 -40.65 69.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.605 1.562 . . . . 10.0 111.949 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.0 56.66 1.43 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 126.223 1.868 . . . . 10.0 113.251 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -129.95 -22.75 2.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 -173.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.18 105.13 0.48 Allowed Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 126.067 1.747 . . . . 10.0 113.538 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -79.97 62.32 8.48 Favored 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.11 3.207 . . . . 10.0 114.085 -163.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.13 60.63 0.18 Allowed Glycine 0 N--CA 1.471 1.027 0 C-N-CA 124.891 1.234 . . . . 10.0 112.341 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.406 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 34.1 t80 -143.63 170.75 15.25 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.545 1.538 . . . . 10.0 109.748 -169.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.6 t -152.84 153.6 33.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 122.08 0.943 . . . . 10.0 110.946 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -155.26 -105.14 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.737 -1.119 . . . . 10.0 110.369 -150.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 50.3 p -141.78 9.44 1.97 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.352 1.061 . . . . 10.0 112.859 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 48.95 -50.14 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.553 3.141 . . . . 10.0 115.009 -159.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.47 -41.22 9.24 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.725 2.01 . . . . 10.0 113.192 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -48.57 -60.9 2.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.514 1.526 . . . . 10.0 112.843 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -33.7 61.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.171 0.988 . . . . 10.0 112.12 179.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.71 -32.8 74.34 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.429 1.092 . . . . 10.0 113.488 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -50.58 73.51 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.898 0.772 . . . . 10.0 110.357 172.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.84 128.54 0.55 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 123.46 0.553 . . . . 10.0 113.59 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -170.71 13.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 126.952 2.101 . . . . 10.0 112.375 -162.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.6 m 44.92 56.58 5.23 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.303 1.441 . . . . 10.0 114.238 152.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.432 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 40.3 m95 -52.43 135.82 32.73 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -163.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -177.72 -167.47 0.15 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 130.702 3.601 . . . . 10.0 110.579 -168.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -68.74 32.81 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.301 2.641 . . . . 10.0 116.713 -159.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.21 -57.67 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.392 -1.442 . . . . 10.0 111.784 -169.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.4 p -53.63 -44.54 69.62 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 130.942 3.697 . . . . 10.0 111.479 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.9 mp -65.18 -32.98 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.436 1.016 . . . . 10.0 113.37 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.9 mtm -75.24 -25.99 58.53 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 120.116 1.325 . . . . 10.0 111.84 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -75.52 -47.58 26.3 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 118.929 0.786 . . . . 10.0 111.708 162.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.68 -43.33 89.61 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 114.009 1.114 . . . . 10.0 114.009 -173.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -64.36 -41.35 96.78 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.326 1.421 . . . . 10.0 111.68 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -68.6 -28.76 67.21 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.902 1.075 . . . . 10.0 113.902 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -161.34 86.88 1.66 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.731 1.212 . . . . 10.0 111.276 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.07 -48.17 5.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.355 2.037 . . . . 10.0 113.694 -169.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -69.98 -19.36 63.35 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.177 1.391 . . . . 10.0 113.036 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.38 -47.75 46.97 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.493 1.117 . . . . 10.0 110.191 167.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -71.98 -40.75 68.35 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.643 0.979 . . . . 10.0 113.643 -174.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.0 pt -135.79 126.7 16.98 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.345 1.058 . . . . 10.0 109.324 170.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -70.77 148.84 59.41 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.455 2.103 . . . . 10.0 111.261 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 47.37 66.75 1.76 Allowed Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.066 1.317 . . . . 10.0 113.124 176.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.2 t -123.61 23.27 8.89 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.216 1.406 . . . . 10.0 113.918 -169.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt 47.83 -88.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.181 2.192 . . . . 10.0 113.631 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt 15.21 90.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 131.019 3.728 . . . . 10.0 113.82 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.436 ' H ' HD11 ' A' ' 81' ' ' ILE . 2.6 mp -74.52 54.89 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 126.733 2.013 . . . . 10.0 110.139 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -163.28 66.63 0.19 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.411 1.885 . . . . 10.0 109.709 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.39 112.19 11.45 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.157 0.983 . . . . 10.0 110.408 172.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.26 175.13 32.99 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.766 1.204 . . . . 10.0 113.612 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -143.92 149.47 17.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.317 -1.364 . . . . 10.0 107.317 157.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -66.83 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.277 1.031 . . . . 10.0 113.185 -166.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -77.05 120.99 22.92 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.037 -1.097 . . . . 10.0 108.037 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -63.66 -16.46 61.04 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.073 1.306 . . . . 10.0 113.999 -174.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 m -55.48 -34.94 65.0 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.948 . . . . 10.0 112.421 163.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.19 -38.63 88.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.97 1.308 . . . . 10.0 111.181 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -60.87 -50.71 72.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.626 1.17 . . . . 10.0 110.938 175.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.56 -53.16 61.52 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.459 1.103 . . . . 10.0 111.886 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -56.66 -44.09 81.02 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.315 1.446 . . . . 10.0 110.617 -175.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mp -60.32 -45.65 92.65 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.189 1.181 . . . . 10.0 114.189 175.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mm -61.04 -48.59 88.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.91 73.68 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.76 0.424 . . . . 10.0 111.549 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -51.46 -59.1 4.62 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.792 1.637 . . . . 10.0 112.754 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 48.1 mt -68.45 -36.08 78.51 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.224 0.92 . . . . 10.0 112.15 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -32.46 74.02 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.654 0.661 . . . . 10.0 112.302 178.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.473 ' HZ3' ' CD ' ' A' ' 104' ' ' GLU . 3.0 mmmp? -72.8 -52.6 14.3 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.333 1.453 . . . . 10.0 112.242 165.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.79 -27.98 45.59 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.898 1.444 . . . . 10.0 114.898 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.6 t -76.49 2.78 12.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 115.643 1.719 . . . . 10.0 115.643 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -151.32 -1.84 0.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.026 1.491 . . . . 10.0 115.026 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.473 ' CD ' ' HZ3' ' A' ' 100' ' ' LYS . 10.1 tp10 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 127.525 2.33 . . . . 10.0 114.488 175.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.432 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.179 -0.768 . . . . 10.0 111.179 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.53 135.16 49.96 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.423 0.689 . . . . 10.0 112.645 -155.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.28 -50.61 70.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 125.749 1.62 . . . . 10.0 111.438 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.83 -40.1 87.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.681 1.592 . . . . 10.0 114.084 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.79 -26.48 68.37 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.751 0.82 . . . . 10.0 112.514 169.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.54 -52.02 4.64 Favored Glycine 0 C--N 1.335 0.499 0 N-CA-C 110.281 -1.128 . . . . 10.0 110.281 -178.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.23 38.7 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.769 2.027 . . . . 10.0 114.709 176.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -42.16 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.713 2.405 . . . . 10.0 110.988 175.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 tp -74.83 -33.96 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 119.796 1.18 . . . . 10.0 111.426 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -56.25 -51.12 69.29 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-O 121.25 0.548 . . . . 10.0 109.889 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.7 t -65.19 -9.43 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.543 0.737 . . . . 10.0 112.539 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -94.56 -58.59 2.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.436 1.494 . . . . 10.0 111.038 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -116.99 8.74 13.49 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 116.236 1.939 . . . . 10.0 116.236 -168.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.8 m -118.81 -46.55 2.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.074 1.35 . . . . 10.0 110.842 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.02 62.58 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.05 1.13 . . . . 10.0 114.05 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.28 -12.12 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.757 1.223 . . . . 10.0 114.146 165.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.8 m -143.22 -17.57 0.65 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.083 1.753 . . . . 10.0 114.091 -176.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -132.51 102.07 5.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.699 2.0 . . . . 10.0 112.731 -175.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -67.15 24.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 128.988 2.915 . . . . 10.0 116.943 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.8 p -64.58 -39.33 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 120.404 -1.435 . . . . 10.0 114.483 -168.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -59.9 -14.45 15.53 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.011 1.724 . . . . 10.0 115.064 -160.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -150.31 13.05 0.75 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.1 2.16 . . . . 10.0 110.83 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.85 169.39 2.83 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.74 1.638 . . . . 10.0 113.92 -168.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 159.3 178.88 33.7 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.907 1.242 . . . . 10.0 112.056 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -68.98 168.3 14.04 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 122.026 0.917 . . . . 10.0 110.886 164.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.464 ' CD2' HD21 ' A' ' 31' ' ' ASN . 12.7 m170 -68.27 164.66 20.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.071 1.749 . . . . 10.0 111.478 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.11 -46.66 0.3 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.654 0.613 . . . . 10.0 112.654 -171.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.1 m -154.06 -30.75 0.12 Allowed 'General case' 0 N--CA 1.479 0.987 0 O-C-N 121.09 -1.006 . . . . 10.0 110.977 168.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.69 -174.28 25.82 Favored Glycine 0 CA--C 1.541 1.71 0 N-CA-C 110.402 -1.079 . . . . 10.0 110.402 150.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -65.92 173.83 6.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.639 2.226 . . . . 10.0 110.267 168.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.574 HD22 ' CD2' ' A' ' 33' ' ' HIS . 13.7 p30 -74.01 0.71 12.8 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.391 1.477 . . . . 10.0 112.87 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.47 28.23 15.16 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.429 2.292 . . . . 10.0 114.77 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.615 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -53.74 157.42 2.31 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.826 1.25 . . . . 10.0 112.613 168.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.23 8.69 3.62 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 127.821 2.629 . . . . 10.0 118.787 149.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.436 ' CD2' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -73.17 -173.86 1.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.603 1.702 . . . . 10.0 114.001 -177.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 60.58 48.39 7.47 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.813 1.645 . . . . 10.0 110.367 -152.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 146.06 -17.38 1.74 Allowed Glycine 0 CA--C 1.545 1.927 0 N-CA-C 117.921 1.928 . . . . 10.0 117.921 176.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.615 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 16.2 ttp180 -63.58 3.92 0.3 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.708 2.484 . . . . 10.0 117.708 -165.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.279 0.0 OUTLIER 70.58 -0.76 2.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.944 2.497 . . . . 10.0 116.615 -170.185 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.293 13.8 t 52.47 -43.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 129.585 3.154 . . . . 10.0 116.217 -165.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.85 76.23 0.01 OUTLIER Glycine 0 CA--C 1.534 1.221 0 C-N-CA 126.468 1.985 . . . . 10.0 112.828 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -168.1 123.0 0.97 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.327 2.251 . . . . 10.0 111.203 -175.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.92 119.02 0.97 Allowed Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.149 1.379 . . . . 10.0 109.394 169.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 69.5 2.9 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.678 2.919 . . . . 10.0 112.134 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.12 75.59 1.25 Allowed Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.215 1.864 . . . . 10.0 112.962 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -146.56 179.88 7.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.442 1.497 . . . . 10.0 109.658 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 94.2 m -154.79 88.76 1.2 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.737 1.215 . . . . 10.0 108.838 171.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.485 1.514 . . . . 10.0 110.87 169.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.418 ' HG1' ' ND2' ' A' ' 52' ' ' ASN . 52.4 p -75.19 71.46 2.22 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.149 0.98 . . . . 10.0 110.909 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -55.97 -12.87 1.57 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.215 2.206 . . . . 10.0 116.112 -161.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.33 -26.65 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.452 -1.405 . . . . 10.0 113.141 165.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.418 ' ND2' ' HG1' ' A' ' 49' ' ' THR . 17.2 p30 -78.14 -67.86 0.69 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.345 1.979 . . . . 10.0 116.345 159.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.51 -39.27 48.15 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.134 1.333 . . . . 10.0 113.248 -174.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -19.99 65.5 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.445 1.498 . . . . 10.0 114.043 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -66.92 -27.34 67.41 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.928 1.695 . . . . 10.0 111.648 168.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.79 12.13 64.1 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 115.619 1.007 . . . . 10.0 115.619 168.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -53.82 -10.17 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 127.655 2.382 . . . . 10.0 115.882 -174.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 88.8 m 57.38 128.61 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 130.122 3.369 . . . . 10.0 115.511 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -75.76 145.8 40.51 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.18 -0.918 . . . . 10.0 112.973 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 175.33 175.18 0.23 Allowed 'General case' 0 CA--C 1.538 0.487 1 C-N-CA 133.33 4.652 . . . . 10.0 106.035 -179.421 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.469 ' CD ' ' HZ1' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -51.79 -30.39 22.83 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.517 1.302 . . . . 10.0 114.517 177.223 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -75.43 5.65 5.54 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.978 2.214 . . . . 10.0 116.978 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.2 p -160.53 -31.07 0.06 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.968 1.307 . . . . 10.0 111.706 -171.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 -19.67 58.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.5 1.046 . . . . 10.0 112.468 171.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -60.82 3.19 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 162.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -53.4 -45.71 69.41 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 127.741 2.416 . . . . 10.0 110.124 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -73.47 -46.91 45.34 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 117.867 -1.063 . . . . 10.0 113.371 -178.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.24 -39.78 95.6 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.969 1.713 . . . . 10.0 111.699 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -65.16 -32.5 74.22 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.578 1.081 . . . . 10.0 113.411 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.15 77.05 1.82 Allowed Pre-proline 0 CA--C 1.558 1.271 0 CA-C-N 119.858 1.208 . . . . 10.0 111.802 -175.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.14 -54.81 0.35 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.112 1.875 . . . . 10.0 112.905 -160.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -64.58 -23.03 67.13 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.322 1.849 . . . . 10.0 113.596 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -77.21 -47.44 20.22 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.622 1.169 . . . . 10.0 111.758 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.89 -45.0 94.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.1 pt -136.65 145.94 53.32 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.838 0.855 . . . . 10.0 111.697 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.76 161.04 40.04 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 122.994 2.463 . . . . 10.0 113.266 -168.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.22 -25.16 0.26 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 126.328 1.918 . . . . 10.0 116.84 171.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.8 m -36.68 115.63 0.38 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.18 2.592 . . . . 10.0 114.674 -165.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -86.44 6.66 29.26 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.088 1.514 . . . . 10.0 115.088 177.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.4 ttt -60.4 92.13 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.625 -0.672 . . . . 10.0 109.416 158.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.2 tt -68.06 -17.84 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 122.7 1.238 . . . . 10.0 113.656 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -75.28 78.45 2.38 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.366 2.266 . . . . 10.0 110.728 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.08 59.79 0.18 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.786 1.634 . . . . 10.0 113.193 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.9 -166.12 29.8 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.456 1.503 . . . . 10.0 113.955 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -142.07 155.64 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.951 1.301 . . . . 10.0 109.439 -171.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -67.37 -78.4 0.06 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.158 1.783 . . . . 10.0 113.793 -153.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -76.43 106.75 8.24 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.51 -12.09 2.45 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 116.556 2.058 . . . . 10.0 116.556 -167.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 m -57.68 -40.28 79.05 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.269 1.428 . . . . 10.0 112.798 161.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.88 -35.27 66.32 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.458 1.503 . . . . 10.0 110.863 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.84 2.58 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.59 1.956 . . . . 10.0 114.312 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -157.18 -5.4 0.1 Allowed 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.043 1.337 . . . . 10.0 113.5 -174.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -57.21 -47.67 80.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 140.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.58 -49.47 72.64 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.71 1.604 . . . . 10.0 114.577 170.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 11.2 mm -60.0 -46.43 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.54 83.83 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.184 0.994 . . . . 10.0 112.423 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -58.7 7.39 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.657 1.183 . . . . 10.0 112.083 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.88 -31.6 72.63 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.038 0.836 . . . . 10.0 112.799 -174.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.469 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 30.4 ttpt -64.29 -17.98 64.15 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.483 0.92 . . . . 10.0 113.483 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -92.32 -56.17 3.14 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.568 -1.206 . . . . 10.0 110.273 163.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.12 32.96 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.58 1.696 . . . . 10.0 115.58 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.4 t -68.21 -19.01 64.73 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.692 1.368 . . . . 10.0 114.692 168.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.34 -0.78 0.23 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 116.467 2.025 . . . . 10.0 116.467 -166.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 126.8 2.04 . . . . 10.0 110.611 -171.28 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.461 ' CGA' HH22 ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 110.429 -1.068 . . . . 10.0 110.429 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.96 148.01 44.67 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.327 1.851 . . . . 10.0 112.676 -171.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.03 -38.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 121.625 -0.672 . . . . 10.0 111.581 172.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 4.7 mp0 -57.16 -44.67 83.68 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.1 1.148 . . . . 10.0 114.1 173.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -63.84 -33.47 75.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 117.86 0.3 . . . . 10.0 110.639 173.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.03 -41.68 31.64 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.302 1.429 . . . . 10.0 111.178 -172.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 4' ' ' GLU . 30.7 pttt -69.21 -36.17 76.97 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 118.297 1.049 . . . . 10.0 111.96 174.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.81 -55.91 28.35 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.637 0.775 . . . . 10.0 111.351 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -64.56 -33.24 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.576 0.626 . . . . 10.0 112.564 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -57.65 -52.5 65.17 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 119.126 0.876 . . . . 10.0 110.459 169.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -62.21 -13.3 9.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -97.29 -36.16 10.49 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.494 1.518 . . . . 10.0 112.785 -175.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -137.01 3.63 2.68 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 116.373 1.99 . . . . 10.0 116.373 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -122.77 -43.02 2.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.208 1.403 . . . . 10.0 111.839 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.5 4.9 2.06 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.667 1.358 . . . . 10.0 114.667 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -38.46 14.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.511 1.524 . . . . 10.0 111.932 172.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 m -88.61 -38.04 15.15 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.487 2.315 . . . . 10.0 113.751 168.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.414 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.6 m-70 -114.66 -172.59 2.14 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 129.137 2.975 . . . . 10.0 111.917 -175.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.4 m -166.41 153.1 9.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.68 1.992 . . . . 10.0 108.163 157.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.8 p -156.65 -35.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 113.562 0.949 . . . . 10.0 113.562 169.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -60.33 -4.13 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 130.675 3.59 . . . . 10.0 115.96 -168.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -151.17 7.35 0.52 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.68 2.792 . . . . 10.0 111.662 -170.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.3 160.36 3.08 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.536 1.541 . . . . 10.0 111.943 -161.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 165.31 168.74 27.95 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.83 -1.394 . . . . 10.0 114.125 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -77.13 -152.78 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.935 2.094 . . . . 10.0 111.627 170.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -151.11 136.89 18.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.803 2.041 . . . . 10.0 109.198 -173.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.57 -25.86 0.57 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.691 0.796 . . . . 10.0 112.91 -160.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.5 m -152.86 -21.27 0.16 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.788 -1.195 . . . . 10.0 111.852 170.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.414 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -128.18 172.57 19.16 Favored Glycine 0 CA--C 1.544 1.887 0 C-N-CA 124.488 1.042 . . . . 10.0 110.964 150.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.21 166.02 22.51 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 124.392 3.395 . . . . 10.0 112.416 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.98 137.67 57.88 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.07 -1.019 . . . . 10.0 109.196 159.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.83 60.98 2.38 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.349 1.431 . . . . 10.0 111.981 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.18 87.65 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 130.263 3.425 . . . . 10.0 113.568 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.36 43.04 65.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.953 1.74 . . . . 10.0 114.663 169.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -72.4 149.6 44.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 117.849 0.825 . . . . 10.0 110.577 173.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 75.52 76.41 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.017 2.527 . . . . 10.0 111.609 -161.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.54 29.97 0.23 Allowed Glycine 0 CA--C 1.536 1.361 0 N-CA-C 117.353 1.701 . . . . 10.0 117.353 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.494 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 13.0 ptt85 -152.53 -84.17 0.08 Allowed 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 120.748 2.274 . . . . 10.0 115.787 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.494 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 16.7 pttp -168.28 -176.38 2.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.697 2.799 . . . . 10.0 109.943 -177.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -67.15 -132.72 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.718 2.007 . . . . 10.0 111.873 162.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -18.17 115.96 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 1 C-N-CA 130.708 4.004 . . . . 10.0 117.809 -178.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -152.23 3.52 0.37 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 117.971 2.582 . . . . 10.0 117.971 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 155.0 88.64 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 121.299 1.863 . . . . 10.0 111.874 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.29 74.04 3.16 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.243 2.628 . . . . 10.0 109.637 170.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.48 -73.22 1.63 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.03 1.3 . . . . 10.0 111.624 -170.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 t80 43.6 -143.73 0.12 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.632 1.173 . . . . 10.0 110.102 -164.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.8 m -164.5 108.76 0.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.809 2.044 . . . . 10.0 108.096 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -152.8 176.53 11.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.151 1.38 . . . . 10.0 112.211 -172.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.4 p -80.35 109.78 15.17 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.021 0.915 . . . . 10.0 111.99 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -55.05 -22.41 15.79 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.743 0.817 . . . . 10.0 112.821 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -48.72 -43.04 36.98 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.495 1.118 . . . . 10.0 113.445 170.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.423 ' ND2' ' HZ3' ' A' ' 53' ' ' LYS . 49.9 t-20 -76.58 -38.81 54.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.751 1.221 . . . . 10.0 112.673 172.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.423 ' HZ3' ' ND2' ' A' ' 52' ' ' ASN . 6.8 mmpt? -74.93 -52.11 12.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.819 0.847 . . . . 10.0 110.827 -172.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.97 -21.04 66.39 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.62 1.568 . . . . 10.0 113.466 173.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -28.84 62.85 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.426 1.012 . . . . 10.0 112.815 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.04 4.46 72.48 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 123.878 0.751 . . . . 10.0 114.907 168.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 pp -61.26 178.23 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 10.0 111.313 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.0 m -148.77 108.81 4.08 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 123.256 1.503 . . . . 10.0 111.195 -163.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.521 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 16.5 m95 -54.48 116.37 2.62 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.708 2.003 . . . . 10.0 109.24 169.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 -44.98 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.187 1.395 . . . . 10.0 113.07 -168.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -170.03 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.683 1.993 . . . . 10.0 107.32 162.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -47.34 -54.85 10.04 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.353 2.661 . . . . 10.0 112.399 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -52.72 60.83 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 128.371 2.668 . . . . 10.0 111.962 -176.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.06 -28.34 61.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.919 0.888 . . . . 10.0 112.302 -177.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.87 -55.08 33.47 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.562 0.745 . . . . 10.0 109.957 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.54 -43.79 98.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.458 1.103 . . . . 10.0 110.433 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.8 t80 -66.41 -46.58 76.09 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.038 0.935 . . . . 10.0 112.053 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 -37.25 83.23 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.77 1.623 . . . . 10.0 112.698 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.64 -36.76 84.89 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.036 -0.983 . . . . 10.0 113.063 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -163.45 106.19 0.97 Allowed Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 119.685 1.129 . . . . 10.0 111.873 160.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.43 -48.76 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.481 2.121 . . . . 10.0 110.685 -171.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -37.9 77.2 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.177 1.391 . . . . 10.0 112.475 179.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -61.6 -54.54 41.57 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.69 1.196 . . . . 10.0 110.63 168.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -64.43 -45.25 88.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.918 1.081 . . . . 10.0 113.918 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 pt -136.0 95.45 13.62 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 123.992 0.917 . . . . 10.0 110.548 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.01 76.69 2.05 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 125.035 3.824 . . . . 10.0 113.84 -163.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.51 -25.5 0.03 OUTLIER Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.222 1.868 . . . . 10.0 112.061 165.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.3 t -40.02 116.91 0.7 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.864 2.066 . . . . 10.0 113.975 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -83.18 16.0 2.62 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.148 0.795 . . . . 10.0 113.148 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.8 ttt -67.16 79.1 0.14 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.845 1.307 . . . . 10.0 111.344 171.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tp -72.99 87.07 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 125.307 1.443 . . . . 10.0 111.714 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -161.49 -51.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.01 -0.995 . . . . 10.0 113.547 175.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.02 92.96 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.137 2.175 . . . . 10.0 115.871 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.22 -178.86 36.05 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.638 1.113 . . . . 10.0 111.436 -169.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.5 tt -155.55 82.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.201 1.0 . . . . 10.0 110.35 178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 59.78 -54.18 0.07 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 128.065 2.546 . . . . 10.0 116.157 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.24 166.53 25.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.021 2.529 . . . . 10.0 110.417 -174.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -53.95 -46.23 71.51 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.189 0.995 . . . . 10.0 113.083 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.1 m -68.34 -34.32 75.88 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.669 -0.644 . . . . 10.0 111.896 -175.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -76.86 -10.5 59.41 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.372 1.069 . . . . 10.0 113.445 171.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -35.22 35.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.098 -1.626 . . . . 10.0 114.436 155.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -62.33 -57.14 12.45 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.153 -0.967 . . . . 10.0 111.333 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 58.5 p30 -54.92 -40.65 70.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.725 1.21 . . . . 10.0 112.804 -175.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 14.9 tp -60.94 -53.88 51.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.912 2.485 . . . . 10.0 112.996 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.02 -44.92 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.185 0.994 . . . . 10.0 108.872 174.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.02 -49.97 75.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.661 0.385 . . . . 10.0 111.369 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.8 -61.75 2.1 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.267 1.427 . . . . 10.0 112.068 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.2 mt -59.65 -38.12 80.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.66 1.118 . . . . 10.0 111.815 -176.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -64.76 -24.45 67.56 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.277 1.031 . . . . 10.0 113.596 176.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 100' ' ' LYS . 8.5 mmpt? -87.37 -40.33 14.52 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.847 -1.073 . . . . 10.0 112.239 166.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.68 -22.76 65.6 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.379 1.251 . . . . 10.0 114.379 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t -85.73 9.35 16.67 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 169.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -151.58 21.09 0.72 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.454 2.302 . . . . 10.0 111.88 -166.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.817 1.647 . . . . 10.0 111.217 -174.904 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.521 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -81.99 -177.81 6.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.282 0.633 . . . . 10.0 109.493 160.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.03 -34.14 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 120.672 -1.268 . . . . 10.0 111.041 145.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -71.55 -38.75 70.96 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 127.937 2.495 . . . . 10.0 113.557 -157.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.6 -31.33 72.47 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.19 -54.04 9.65 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 127.254 2.359 . . . . 10.0 110.29 -173.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -44.91 85.4 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.098 0.777 . . . . 10.0 113.098 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -26.97 60.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.93 1.455 . . . . 10.0 114.93 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -81.39 -32.49 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.669 1.577 . . . . 10.0 111.67 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.41 -51.33 69.87 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 121.677 -0.639 . . . . 10.0 110.219 170.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.99 -12.01 8.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -83.54 -61.3 1.87 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.232 1.013 . . . . 10.0 110.855 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -102.64 -38.25 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.599 1.16 . . . . 10.0 112.457 -170.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.7 m -83.08 -55.17 4.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.128 1.371 . . . . 10.0 111.902 -172.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.61 -15.74 42.03 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -172.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -59.6 -54.52 45.47 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 129.378 3.071 . . . . 10.0 111.898 167.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.8 m -87.5 -21.22 25.61 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.117 1.525 . . . . 10.0 115.117 169.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -134.7 57.64 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.966 1.706 . . . . 10.0 111.991 -167.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.83 120.29 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.72 -1.238 . . . . 10.0 110.827 -174.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.48 -58.39 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 127.068 2.147 . . . . 10.0 108.792 -177.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 -62.31 9.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.187 2.995 . . . . 10.0 114.376 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -151.86 17.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.16 1.784 . . . . 10.0 112.75 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.33 142.86 9.1 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.847 1.689 . . . . 10.0 111.444 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.78 129.51 9.18 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.702 1.144 . . . . 10.0 113.15 -172.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -164.19 -179.21 5.99 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 127.415 2.286 . . . . 10.0 109.258 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.9 m170 -149.52 122.17 8.61 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.95 1.3 . . . . 10.0 107.545 -168.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.01 109.58 0.9 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.23 1.412 . . . . 10.0 109.713 -173.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 m 57.09 -43.35 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.902 2.081 . . . . 10.0 114.144 -161.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.5 166.81 12.44 Favored Glycine 0 CA--C 1.543 1.826 0 CA-C-N 120.191 1.36 . . . . 10.0 113.7 169.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 68.4 Cg_endo -74.79 173.58 14.18 Favored 'Trans proline' 0 CA--C 1.541 0.836 1 C-N-CA 125.326 4.017 . . . . 10.0 111.097 167.224 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.582 HD22 ' CD2' ' A' ' 33' ' ' HIS . 5.9 p30 -77.58 -172.48 2.58 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.222 -0.924 . . . . 10.0 108.745 158.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.1 mt -139.37 51.98 1.75 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 122.798 1.285 . . . . 10.0 111.866 -175.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.582 ' CD2' HD22 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -54.22 134.78 44.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.866 2.866 . . . . 10.0 113.165 162.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 54.0 8.38 1.01 Allowed Glycine 0 CA--C 1.54 1.616 0 N-CA-C 118.883 2.313 . . . . 10.0 118.883 160.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -51.55 167.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.784 1.634 . . . . 10.0 111.027 170.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 61.99 36.31 15.64 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.765 1.226 . . . . 10.0 112.554 -169.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 168.4 -42.82 0.23 Allowed Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.565 1.555 . . . . 10.0 110.894 -175.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 41.6 mtp85 -80.81 159.65 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 122.442 1.115 . . . . 10.0 112.067 167.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -70.71 173.91 6.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.682 1.993 . . . . 10.0 110.998 168.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -67.74 168.76 10.77 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.327 1.851 . . . . 10.0 111.334 157.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.08 14.69 51.01 Favored Glycine 0 N--CA 1.471 0.998 0 N-CA-C 117.657 1.823 . . . . 10.0 117.657 160.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.402 ' CD ' ' H ' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -91.86 -40.52 11.14 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.952 2.101 . . . . 10.0 115.269 -158.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.63 111.17 2.81 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.13 1.372 . . . . 10.0 114.228 -164.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 131.01 18.79 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.417 2.078 . . . . 10.0 112.129 -174.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.01 1.8 69.49 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.91 0.724 . . . . 10.0 114.91 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.409 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 16.5 t80 -73.2 179.27 3.96 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 118.433 1.117 . . . . 10.0 111.052 167.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 98.7 m -154.18 89.02 1.26 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 119.517 -1.99 . . . . 10.0 109.631 176.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.35 173.61 10.8 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 128.508 2.723 . . . . 10.0 112.277 172.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.8 p -71.21 143.87 50.31 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.423 -0.798 . . . . 10.0 110.508 163.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -76.23 65.14 2.13 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.648 -1.283 . . . . 10.0 111.154 166.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.96 -59.35 0.6 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.203 1.001 . . . . 10.0 110.474 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.438 ' CG ' ' H ' ' A' ' 53' ' ' LYS . 6.0 p30 -54.88 -70.1 0.11 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.919 1.687 . . . . 10.0 111.231 174.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -63.68 -13.13 40.07 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 130.566 3.547 . . . . 10.0 115.309 171.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.29 -56.27 7.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.178 -0.951 . . . . 10.0 111.485 160.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -56.3 -27.95 57.2 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.385 1.874 . . . . 10.0 115.448 -170.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.97 7.09 61.54 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.967 1.147 . . . . 10.0 115.967 168.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -56.93 5.96 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 129.463 3.105 . . . . 10.0 117.155 -171.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.6 m 50.59 87.8 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.39 2.676 . . . . 10.0 113.627 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.565 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 3.5 m95 -54.45 125.17 18.48 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.601 2.361 . . . . 10.0 114.987 -171.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -164.66 179.17 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.386 2.674 . . . . 10.0 109.343 -173.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -58.01 -39.3 77.96 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.173 -0.954 . . . . 10.0 112.784 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.89 10.28 0.22 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.444 1.898 . . . . 10.0 115.251 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.2 p -158.21 -33.13 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.757 1.223 . . . . 10.0 111.464 -166.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.13 -29.35 63.98 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 120.469 1.486 . . . . 10.0 112.508 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 73.9 mtm -71.52 -40.1 70.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.251 0.932 . . . . 10.0 111.844 175.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -50.48 72.02 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 167.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.5 -44.73 86.12 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 113.361 0.874 . . . . 10.0 113.361 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -73.38 -22.59 60.23 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 121.047 1.749 . . . . 10.0 113.715 176.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -85.75 -23.85 27.13 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.26 1.208 . . . . 10.0 114.26 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.64 65.56 1.97 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.942 1.297 . . . . 10.0 111.445 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -62.05 -51.55 3.61 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.993 2.462 . . . . 10.0 113.267 -164.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -70.72 -20.8 62.62 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.165 1.786 . . . . 10.0 112.734 -173.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -76.28 -54.39 6.85 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.376 1.47 . . . . 10.0 111.148 163.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -56.87 -45.8 82.24 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.191 0.597 . . . . 10.0 112.335 -175.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.2 pt -133.44 111.91 12.83 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.632 1.173 . . . . 10.0 109.663 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.91 161.11 40.91 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.789 1.66 . . . . 10.0 110.306 175.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.36 5.8 82.58 Favored Glycine 0 CA--C 1.536 1.373 0 CA-C-O 118.648 -1.085 . . . . 10.0 114.769 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m -93.79 122.22 36.04 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.526 1.663 . . . . 10.0 110.769 165.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.26 -10.19 55.05 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.598 1.332 . . . . 10.0 114.598 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttt -21.65 97.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.855 2.862 . . . . 10.0 114.853 -172.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.09 69.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 125.652 1.581 . . . . 10.0 109.93 -172.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -164.23 -37.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.069 1.747 . . . . 10.0 111.662 170.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.31 -8.7 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 120.8 3.63 . . . . 10.0 120.8 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.09 118.94 0.75 Allowed Glycine 0 CA--C 1.53 1.003 0 CA-C-N 121.185 1.812 . . . . 10.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.0 tt -66.78 -1.71 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 115.332 1.604 . . . . 10.0 115.332 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.0 tttt 70.34 178.01 0.26 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.09 1.756 . . . . 10.0 111.302 -177.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.418 ' HE2' ' OE2' ' A' ' 90' ' ' GLU . 17.8 mtmm 34.26 -105.3 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 127.435 2.294 . . . . 10.0 112.931 -172.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -178.86 -42.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 CA-C-N 120.449 1.477 . . . . 10.0 114.036 171.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.1 m -54.06 -34.63 60.58 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.604 1.162 . . . . 10.0 111.785 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.418 ' OE2' ' HE2' ' A' ' 87' ' ' LYS . 50.2 mp0 -51.75 -41.5 61.64 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.205 2.202 . . . . 10.0 111.891 172.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -49.0 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.357 1.463 . . . . 10.0 110.829 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -68.39 -32.97 73.41 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.533 1.06 . . . . 10.0 112.503 175.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -44.67 96.7 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.37 -0.832 . . . . 10.0 111.439 169.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp -58.53 -35.79 72.85 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.023 1.119 . . . . 10.0 114.023 171.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.51 -53.14 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.88 0.764 . . . . 10.0 109.17 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -49.42 77.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.871 0.468 . . . . 10.0 111.72 178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.22 -50.88 68.28 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.148 1.379 . . . . 10.0 112.662 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.78 -32.56 65.69 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.861 1.664 . . . . 10.0 112.31 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.07 -38.83 80.36 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.132 0.878 . . . . 10.0 111.618 170.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -65.41 -70.91 0.21 Allowed 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 117.282 -1.342 . . . . 10.0 111.635 163.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.41 -17.57 13.54 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 116.146 1.906 . . . . 10.0 116.146 -166.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 28.4 p -76.23 -0.45 22.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.437 1.495 . . . . 10.0 114.131 167.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.52 -19.89 0.17 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.925 2.49 . . . . 10.0 114.944 -178.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.227 2.611 . . . . 10.0 110.901 -171.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.565 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.77 0 CA-C-O 119.03 -0.872 . . . . 10.0 111.696 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -129.98 147.33 51.72 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.524 0.935 . . . . 10.0 113.524 -150.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.1 -53.77 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.324 1.45 . . . . 10.0 111.615 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.02 -50.2 74.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.893 1.677 . . . . 10.0 113.496 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.96 -37.08 42.3 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 124.099 0.96 . . . . 10.0 112.082 167.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.28 -52.93 8.1 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.619 -1.392 . . . . 10.0 109.619 -174.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -58.09 -47.12 84.18 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 118.974 1.387 . . . . 10.0 112.31 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -27.0 65.26 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 tp -90.65 -28.82 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.58 1.082 . . . . 10.0 112.551 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.48 -53.02 62.41 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.597 0.759 . . . . 10.0 109.771 166.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.43 -10.63 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -84.99 -57.68 3.0 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.723 1.209 . . . . 10.0 110.895 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -130.41 13.22 5.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.268 1.581 . . . . 10.0 115.268 -168.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.1 m -120.57 -45.29 2.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.906 1.283 . . . . 10.0 111.548 170.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.42 -28.79 70.04 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 114.201 1.186 . . . . 10.0 114.201 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -4.25 3.22 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.709 1.604 . . . . 10.0 114.282 171.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -143.56 6.69 1.46 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.168 2.187 . . . . 10.0 112.69 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -158.47 102.28 1.72 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.746 1.619 . . . . 10.0 108.903 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 p -52.6 -47.83 66.67 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.087 1.884 . . . . 10.0 116.087 -169.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 t 34.12 -82.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 130.134 3.374 . . . . 10.0 115.857 170.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.27 2.22 0.89 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.081 2.152 . . . . 10.0 113.272 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -151.16 134.31 15.99 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 128.839 2.856 . . . . 10.0 107.87 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.73 74.08 1.82 Allowed Glycine 0 CA--C 1.531 1.063 0 C-N-CA 123.993 0.806 . . . . 10.0 113.574 -172.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.54 159.54 23.45 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-N 117.747 0.774 . . . . 10.0 114.792 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 61.91 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 129.489 3.115 . . . . 10.0 115.768 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.4 m80 70.33 -63.99 0.38 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.545 2.738 . . . . 10.0 113.022 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 50.23 103.37 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 129.236 3.014 . . . . 10.0 113.497 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m 58.3 -25.63 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 128.46 2.704 . . . . 10.0 117.203 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.68 148.76 20.03 Favored Glycine 0 CA--C 1.538 1.496 0 CA-C-N 120.97 1.713 . . . . 10.0 111.787 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -78.34 61.71 7.92 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.019 3.146 . . . . 10.0 114.801 -160.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 49.11 0.81 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 120.536 3.532 . . . . 10.0 120.536 165.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mm? 42.56 60.41 2.4 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.592 1.957 . . . . 10.0 110.798 -171.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.79 168.51 0.28 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.92 -1.036 . . . . 10.0 109.678 157.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -23.27 110.57 0.01 OUTLIER Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.645 1.593 . . . . 10.0 113.519 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.95 -74.59 0.61 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.799 1.24 . . . . 10.0 110.036 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -64.88 84.99 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.506 1.922 . . . . 10.0 111.34 -171.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.71 -4.42 2.45 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.756 1.645 . . . . 10.0 114.696 -172.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -152.74 -172.23 4.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.365 1.466 . . . . 10.0 111.2 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -85.62 -173.71 4.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -175.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -60.78 -151.84 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.004 1.722 . . . . 10.0 111.992 158.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 95.07 -67.33 1.23 Allowed Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.662 -1.899 . . . . 10.0 116.314 167.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -69.25 25.33 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 118.954 2.946 . . . . 10.0 118.954 -152.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.24 113.59 8.41 Favored Pre-proline 0 CA--C 1.554 1.109 0 CA-C-N 121.562 1.983 . . . . 10.0 112.755 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.56 70.78 6.73 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.34 2.693 . . . . 10.0 112.832 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.86 69.76 1.16 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.556 1.074 . . . . 10.0 112.874 172.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -151.74 176.65 11.19 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.064 1.746 . . . . 10.0 109.04 174.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -152.19 115.6 4.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.908 2.083 . . . . 10.0 107.885 -165.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -61.23 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.195 1.398 . . . . 10.0 111.103 -161.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.7 t -162.57 165.73 25.6 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 128.802 2.841 . . . . 10.0 108.874 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.08 -67.5 0.6 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.597 1.159 . . . . 10.0 110.741 157.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.21 -65.07 0.21 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 129.111 2.965 . . . . 10.0 115.333 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.54 HD21 ' CGD' ' A' ' 105' ' ' HEC . 16.1 t30 -51.87 -70.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.07 0.85 . . . . 10.0 111.57 -176.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.455 ' HZ3' ' CGA' ' A' ' 105' ' ' HEC . 12.3 mtpt -74.46 -16.6 60.85 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.853 -165.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.85 -57.66 7.4 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.852 1.261 . . . . 10.0 113.775 157.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -14.93 48.02 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 115.673 1.731 . . . . 10.0 115.673 -163.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.55 11.06 85.66 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 117.915 1.926 . . . . 10.0 117.915 151.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.72 156.16 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 119.819 1.81 . . . . 10.0 113.458 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 m -68.02 108.87 3.24 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.46 1.504 . . . . 10.0 110.716 176.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.465 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 0.0 OUTLIER -76.76 112.38 13.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.82 -0.55 . . . . 10.0 111.555 172.186 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -162.17 -162.57 0.84 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.03 1.332 . . . . 10.0 109.695 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.84 -66.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 131.091 3.756 . . . . 10.0 113.21 -174.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -58.36 -54.62 44.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.247 1.419 . . . . 10.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 78.7 p -67.84 -35.9 79.39 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.039 0.936 . . . . 10.0 112.973 -173.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.18 -27.51 59.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 119.832 1.196 . . . . 10.0 113.504 173.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 69.6 mtm -65.91 -52.13 52.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 119.446 1.021 . . . . 10.0 109.406 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.9 -44.38 91.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.136 0.493 . . . . 10.0 110.477 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -63.89 -55.72 20.63 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.22 -10.78 59.78 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 121.066 1.757 . . . . 10.0 113.348 -177.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -85.37 -25.42 27.08 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.798 1.181 . . . . 10.0 113.978 167.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -162.33 98.37 1.14 Allowed Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.618 1.099 . . . . 10.0 112.974 157.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.35 -47.68 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.765 1.643 . . . . 10.0 112.042 -167.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -64.89 -32.01 73.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.456 1.502 . . . . 10.0 113.027 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -75.78 -39.13 57.53 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-O 118.108 -0.949 . . . . 10.0 112.728 168.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -68.8 -40.18 79.72 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.517 0.932 . . . . 10.0 113.517 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.02 135.25 25.53 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.803 0.841 . . . . 10.0 110.998 174.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -80.18 50.54 3.57 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.088 3.192 . . . . 10.0 114.544 -157.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.48 61.77 0.01 OUTLIER Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.422 -0.799 . . . . 10.0 114.637 172.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -80.1 -30.16 39.13 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.463 1.283 . . . . 10.0 114.463 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 -22.28 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 117.001 2.223 . . . . 10.0 117.001 -166.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.9 ttt -34.76 100.52 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 129.071 2.948 . . . . 10.0 113.803 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 28.5 mt -76.41 71.74 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 125.879 1.672 . . . . 10.0 109.644 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -163.51 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.254 1.022 . . . . 10.0 113.236 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.78 -15.13 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 120.26 3.43 . . . . 10.0 120.26 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.67 158.52 28.69 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-N 121.695 2.043 . . . . 10.0 113.498 172.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.3 tt -78.96 -79.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.111 1.523 . . . . 10.0 115.111 -169.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -156.9 -52.76 0.08 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.024 1.73 . . . . 10.0 111.635 -169.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -162.99 161.41 25.53 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 129.627 3.171 . . . . 10.0 107.306 174.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -57.26 -46.66 82.84 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.998 0.74 . . . . 10.0 112.998 -168.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . 0.266 83.5 m -64.56 -26.61 68.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.368 1.248 . . . . 10.0 114.368 -176.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.77 -33.84 76.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.357 1.435 . . . . 10.0 111.621 169.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -45.11 77.54 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.73 1.612 . . . . 10.0 110.121 170.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -63.58 -35.56 80.91 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.99 1.316 . . . . 10.0 112.363 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -63.73 -48.97 74.9 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.822 1.649 . . . . 10.0 111.243 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.42 -35.41 62.88 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.8 mm -59.37 -57.19 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 172.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.34 95.91 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.81 0.444 . . . . 10.0 111.946 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -53.53 -63.23 1.21 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.7 1.2 . . . . 10.0 111.522 170.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.24 -27.93 69.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.605 1.093 . . . . 10.0 113.426 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -59.54 -16.76 27.03 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.693 1.133 . . . . 10.0 113.511 170.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.41 33.57 3.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.801 2.04 . . . . 10.0 113.235 165.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.23 24.58 2.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.586 1.155 . . . . 10.0 111.398 171.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -127.68 2.25 6.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.573 1.549 . . . . 10.0 113.242 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -159.64 -59.0 0.06 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.344 1.857 . . . . 10.0 109.649 -154.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 C--O 1.256 1.426 0 CA-C-O 117.004 -1.474 . . . . 10.0 109.446 134.09 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.54 ' CGD' HD21 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.029 0 CA-C-O 117.478 -1.734 . . . . 10.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -131.01 168.15 17.85 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 -166.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.58 -65.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.23 2.612 . . . . 10.0 110.596 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.0 -37.59 74.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.404 1.482 . . . . 10.0 113.243 174.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.461 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 5.7 mmpt? -64.84 -16.4 63.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.659 -0.686 . . . . 10.0 112.315 171.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.06 -50.58 1.23 Allowed Glycine 0 N--CA 1.468 0.81 0 C-N-CA 125.974 1.749 . . . . 10.0 112.793 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -60.03 -29.62 68.62 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.629 1.215 . . . . 10.0 113.651 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HE2' ' HE2' ' A' ' 5' ' ' LYS . 15.8 pttp -64.22 -32.18 73.66 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.995 0.918 . . . . 10.0 112.532 174.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.82 -47.93 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.603 0.761 . . . . 10.0 109.244 168.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -57.54 -53.56 56.82 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.958 0.345 . . . . 10.0 111.46 -174.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -63.27 -15.42 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 112.706 0.632 . . . . 10.0 112.706 -175.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -95.88 -63.74 1.12 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.051 2.141 . . . . 10.0 111.055 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -87.67 -17.9 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 -171.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -116.22 -52.63 2.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.148 0.979 . . . . 10.0 111.117 -169.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.57 3.71 7.27 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.564 0.95 . . . . 10.0 113.564 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.19 -67.22 0.27 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.439 1.896 . . . . 10.0 108.777 153.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.9 m -82.2 -35.36 28.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.137 1.375 . . . . 10.0 113.906 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.78 -163.0 0.96 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.861 2.465 . . . . 10.0 112.38 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 21' ' ' GLU . 8.3 t -138.15 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.477 1.111 . . . . 10.0 113.215 169.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 40.97 -25.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.346 1 C-N-CA 132.86 4.464 . . . . 10.0 118.295 -161.994 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' ' 19' ' ' THR . 86.0 tt0 -140.55 -61.33 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.275 2.23 . . . . 10.0 109.742 -169.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -78.32 88.52 4.35 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.035 0.754 . . . . 10.0 113.035 177.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.28 -0.07 63.57 Favored Glycine 0 CA--C 1.537 1.42 0 N-CA-C 118.627 2.211 . . . . 10.0 118.627 150.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.57 -0.5 81.08 Favored Glycine 0 CA--C 1.536 1.387 0 CA-C-N 120.573 2.186 . . . . 10.0 117.241 166.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.79 155.63 38.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.03 1.332 . . . . 10.0 113.439 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -153.18 127.77 9.38 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.192 0.997 . . . . 10.0 110.056 165.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -144.44 -73.14 0.26 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.507 1.123 . . . . 10.0 110.914 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m -84.83 -16.9 39.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.368 0.667 . . . . 10.0 111.716 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.56 163.22 28.99 Favored Glycine 0 CA--C 1.544 1.859 0 C-N-CA 124.984 1.278 . . . . 10.0 111.662 164.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.36 175.22 2.81 Favored 'Trans proline' 0 C--N 1.353 0.794 1 C-N-CA 125.653 4.236 . . . . 10.0 113.901 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -86.9 0.39 55.09 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.598 1.333 . . . . 10.0 114.598 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 mp 58.27 -31.63 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.105 3.362 . . . . 10.0 115.714 -174.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.09 68.13 0.16 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.549 3.14 . . . . 10.0 113.251 176.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.45 -51.74 2.21 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 126.75 2.119 . . . . 10.0 113.867 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 tp 66.86 -58.12 0.4 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.222 2.609 . . . . 10.0 115.252 173.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.16 115.77 6.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.392 1.077 . . . . 10.0 109.588 -170.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 -8.04 71.59 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 127.076 2.274 . . . . 10.0 114.217 -174.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -87.79 -83.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.082 1.353 . . . . 10.0 114.469 -168.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.65 175.42 1.09 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.341 2.656 . . . . 10.0 111.991 161.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.1 t -82.24 166.31 19.68 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.997 2.119 . . . . 10.0 111.371 163.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.12 -14.64 2.16 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 126.116 1.817 . . . . 10.0 116.789 159.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.72 -5.48 5.88 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 129.042 2.937 . . . . 10.0 115.333 -173.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -46.78 128.54 8.56 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 126.009 1.724 . . . . 10.0 111.851 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.62 106.4 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 123.233 2.622 . . . . 10.0 111.153 -172.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.53 -44.38 1.43 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.21 1.386 . . . . 10.0 113.724 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.43 134.48 56.49 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 122.467 1.127 . . . . 10.0 110.287 -173.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.4 m -150.73 86.36 1.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 123.607 1.67 . . . . 10.0 106.823 -156.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.48 142.8 30.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 131.621 3.968 . . . . 10.0 108.305 173.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.6 t 45.36 -138.31 0.49 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.74 0.816 . . . . 10.0 111.734 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -161.24 -65.69 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.032 1.733 . . . . 10.0 110.433 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.6 -54.69 43.01 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.085 1.354 . . . . 10.0 112.607 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -56.84 -45.86 82.09 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 119.676 1.126 . . . . 10.0 112.561 175.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mmmt -53.81 -49.94 67.24 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.386 1.074 . . . . 10.0 111.722 173.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -66.03 -38.41 88.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.842 1.257 . . . . 10.0 113.219 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -161.07 81.88 0.63 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.438 1.895 . . . . 10.0 110.726 -166.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -118.24 165.58 12.79 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.369 1.462 . . . . 10.0 111.289 164.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -68.11 169.34 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.929 1.691 . . . . 10.0 114.807 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.7 m -72.22 110.19 6.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.296 1.439 . . . . 10.0 111.06 167.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -61.66 140.83 58.12 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.425 1.09 . . . . 10.0 111.388 161.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -178.31 -33.03 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 125.731 1.612 . . . . 10.0 114.998 -169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 166.46 -61.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.696 2.798 . . . . 10.0 112.306 158.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -41.49 85.31 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.84 1.256 . . . . 10.0 112.091 -177.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -54.71 -38.86 67.58 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.596 1.159 . . . . 10.0 112.579 168.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.2 mp -75.35 -28.64 59.66 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 119.881 1.219 . . . . 10.0 113.579 172.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 38.3 mtt -61.53 -53.61 54.11 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.987 1.267 . . . . 10.0 108.589 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.14 -37.81 88.6 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.699 0.285 . . . . 10.0 110.977 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.04 -45.54 81.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.198 -0.906 . . . . 10.0 113.183 175.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -37.88 89.05 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 120.931 1.696 . . . . 10.0 111.633 176.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -70.2 -24.65 63.15 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.726 1.38 . . . . 10.0 114.726 174.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.8 75.71 2.3 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 119.855 1.207 . . . . 10.0 114.01 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -70.88 -45.71 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.973 1.782 . . . . 10.0 112.224 -168.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -68.84 21.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.82 2.848 . . . . 10.0 114.658 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -161.47 -30.75 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.843 1.657 . . . . 10.0 112.786 -167.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.774 1.028 . . . . 10.0 113.774 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.11 157.11 79.11 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 125.419 1.488 . . . . 10.0 110.257 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.11 117.92 5.26 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.604 2.203 . . . . 10.0 110.603 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 85.64 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.802 1.191 . . . . 10.0 113.612 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -127.28 150.61 49.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.053 1.341 . . . . 10.0 110.53 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -142.0 26.6 1.85 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.763 1.625 . . . . 10.0 113.118 -171.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.3 ttt -55.8 103.97 0.12 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.84 0.856 . . . . 10.0 110.554 159.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.73 79.98 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.578 1.151 . . . . 10.0 109.467 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -161.91 -63.29 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.153 0.581 . . . . 10.0 111.983 174.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.48 -2.63 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 120.495 3.517 . . . . 10.0 120.495 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -145.6 86.47 0.17 Allowed Glycine 0 CA--C 1.529 0.937 0 CA-C-N 120.9 1.682 . . . . 10.0 112.262 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.8 tt -64.24 -57.76 10.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 114.12 1.155 . . . . 10.0 114.12 -170.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm 163.4 -168.75 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 131.667 3.987 . . . . 10.0 109.095 -174.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -53.12 -61.78 2.07 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 128.335 2.654 . . . . 10.0 115.582 -167.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.5 -40.61 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.518 1.527 . . . . 10.0 114.456 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -50.82 60.31 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.397 1.479 . . . . 10.0 111.656 -173.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -53.9 -49.06 69.43 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.389 0.675 . . . . 10.0 110.994 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -33.34 75.24 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.517 1.127 . . . . 10.0 112.788 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -76.68 -33.88 58.23 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 120.394 1.452 . . . . 10.0 114.428 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -69.91 -46.5 65.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.606 1.094 . . . . 10.0 112.069 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.58 -39.99 85.91 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.75 1.22 . . . . 10.0 113.265 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mm -65.0 -44.01 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.289 1.036 . . . . 10.0 110.479 173.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.73 -41.2 97.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.299 0.64 . . . . 10.0 111.75 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -56.72 -59.01 5.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.203 1.001 . . . . 10.0 112.418 170.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.8 -27.68 66.08 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.931 1.086 . . . . 10.0 113.931 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -58.89 -28.19 65.92 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.654 1.182 . . . . 10.0 112.637 167.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.403 ' HZ2' ' CD ' ' A' ' 104' ' ' GLU . 1.9 tmtp? -81.94 -51.92 7.59 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.931 1.293 . . . . 10.0 111.549 167.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.45 -12.52 15.07 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 116.39 1.996 . . . . 10.0 116.39 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.3 t -72.3 -0.8 13.18 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.723 -1.235 . . . . 10.0 114.312 164.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -151.12 -22.32 0.21 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.94 1.696 . . . . 10.0 113.519 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.403 ' CD ' ' HZ2' ' A' ' 100' ' ' LYS . 9.5 tt0 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 127.652 2.381 . . . . 10.0 109.965 172.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.822 0 CA-C-O 119.263 -0.743 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -127.78 136.55 51.64 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.623 0.725 . . . . 10.0 112.583 -150.096 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.49 -58.86 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.141 1.777 . . . . 10.0 110.989 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -60.25 -48.58 81.11 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.031 1.333 . . . . 10.0 113.153 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -53.33 -35.01 59.73 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.497 0.719 . . . . 10.0 111.721 170.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.31 -53.55 7.56 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.934 1.254 . . . . 10.0 110.38 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 97' ' ' TYR . 1.2 ptpt -58.75 -44.73 90.62 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.346 1.573 . . . . 10.0 112.679 177.154 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -39.7 79.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 118.07 -0.967 . . . . 10.0 112.898 -178.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -73.47 -33.16 39.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.929 1.241 . . . . 10.0 111.955 174.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -56.78 -50.56 71.95 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.284 -0.885 . . . . 10.0 110.077 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.2 t -60.15 -14.29 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -94.22 -56.62 2.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.267 1.427 . . . . 10.0 111.503 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -108.11 1.66 22.45 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.15 1.537 . . . . 10.0 115.15 -172.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.0 m -123.8 -49.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.126 1.37 . . . . 10.0 112.455 -179.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.68 2.93 2.81 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.921 1.082 . . . . 10.0 113.921 178.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -59.03 6.1 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.477 -0.764 . . . . 10.0 109.359 158.215 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.4 m -87.58 -28.06 22.16 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.608 1.336 . . . . 10.0 114.608 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -108.35 -168.95 1.43 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.795 2.038 . . . . 10.0 111.558 -176.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.285 6.5 t -137.33 -75.17 0.41 Allowed 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 117.471 -1.252 . . . . 10.0 113.33 165.188 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 6.7 p 45.58 -56.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 130.394 3.478 . . . . 10.0 116.587 -170.553 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -67.93 -10.14 50.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.245 1.818 . . . . 10.0 113.309 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -152.71 148.68 27.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.391 1.877 . . . . 10.0 110.356 -171.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.0 76.6 1.59 Allowed Glycine 0 CA--C 1.527 0.808 0 C-N-CA 125.486 1.517 . . . . 10.0 112.905 -176.359 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.77 -139.87 8.9 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.674 1.13 . . . . 10.0 111.267 169.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 64.51 0.24 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.352 1.061 . . . . 10.0 109.729 169.62 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 59.11 178.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.836 1.654 . . . . 10.0 110.891 -170.359 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -150.82 -110.17 0.06 Allowed 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.97 -1.081 . . . . 10.0 109.454 156.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.0 m -72.18 -27.74 62.77 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.266 1.826 . . . . 10.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.67 176.91 16.57 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 126.047 1.784 . . . . 10.0 111.471 166.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.89 177.13 8.07 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.952 3.101 . . . . 10.0 112.266 177.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.53 10.48 27.71 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.941 2.096 . . . . 10.0 114.743 -175.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.477 ' C ' ' HD1' ' A' ' 33' ' ' HIS . 7.4 mp 57.6 -16.59 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 128.809 2.844 . . . . 10.0 116.029 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.477 ' HD1' ' C ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER 33.94 68.99 0.15 Allowed 'General case' 0 C--O 1.24 0.591 0 C-N-CA 129.546 3.138 . . . . 10.0 115.768 156.738 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 67.02 2.37 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 125.503 1.525 . . . . 10.0 111.11 -176.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.01 171.29 2.28 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 117.993 0.896 . . . . 10.0 112.304 -176.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 76.37 130.09 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 127.642 2.377 . . . . 10.0 114.424 171.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.44 -39.82 1.5 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.004 1.764 . . . . 10.0 113.822 -179.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -169.93 0.68 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.777 1.631 . . . . 10.0 113.929 174.089 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.525 ' HZ3' ' NE2' ' A' ' 42' ' ' GLN . 31.2 mtmm -77.43 -164.43 0.48 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.793 1.637 . . . . 10.0 113.036 -174.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -107.3 -99.03 0.36 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 117.586 -1.197 . . . . 10.0 109.981 168.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 7.54 -103.94 0.01 OUTLIER Glycine 0 N--CA 1.477 1.389 0 C-N-CA 130.144 3.735 . . . . 10.0 117.743 -177.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.525 ' NE2' ' HZ3' ' A' ' 39' ' ' LYS . 11.2 mm100 46.42 -14.27 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.087 1 C-N-CA 133.179 4.592 . . . . 10.0 121.695 161.208 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 109.98 2.85 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 121.377 1.899 . . . . 10.0 114.04 -174.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.26 62.59 8.49 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 124.037 3.158 . . . . 10.0 113.593 -167.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.45 50.97 0.08 OUTLIER Glycine 0 N--CA 1.473 1.11 0 C-N-CA 124.924 1.25 . . . . 10.0 113.299 175.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -145.92 -177.86 5.81 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.197 2.199 . . . . 10.0 108.078 -176.026 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.7 m -154.49 135.53 13.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 119.715 -1.866 . . . . 10.0 109.105 176.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -138.64 173.83 11.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.09 1.356 . . . . 10.0 112.061 -166.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.8 p -69.63 160.49 31.47 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.185 1.394 . . . . 10.0 112.557 172.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -64.8 -178.19 0.4 Allowed 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 114.916 -1.038 . . . . 10.0 111.041 161.44 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.02 -72.0 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.914 2.485 . . . . 10.0 114.02 -173.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -62.36 -64.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.153 0.978 . . . . 10.0 112.273 -169.09 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -39.64 43.95 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.531 -1.355 . . . . 10.0 113.869 175.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -65.63 -60.74 2.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.881 0.764 . . . . 10.0 112.741 178.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.37 -48.56 16.98 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.646 0.778 . . . . 10.0 112.766 -176.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.11 176.3 23.03 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.123 1.344 . . . . 10.0 115.481 -177.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -168.46 2.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 127.568 2.347 . . . . 10.0 112.099 -165.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . 0.266 2.4 m 53.83 113.64 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.022 2.529 . . . . 10.0 114.979 -174.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.55 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 38.3 m95 -64.5 156.22 30.35 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.524 -1.216 . . . . 10.0 110.26 163.146 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -174.43 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.697 1.599 . . . . 10.0 112.104 -175.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 165.69 -64.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 130.484 3.514 . . . . 10.0 110.012 173.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -46.11 -56.54 5.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.357 1.863 . . . . 10.0 112.769 -179.764 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 75.7 p -61.41 -36.01 79.12 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.679 1.592 . . . . 10.0 112.163 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -32.37 60.91 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.137 0.975 . . . . 10.0 113.051 173.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.9 mtm -63.62 -47.64 80.57 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 118.091 -0.957 . . . . 10.0 109.504 173.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -66.0 -43.01 88.99 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.554 0.616 . . . . 10.0 111.14 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -63.06 -49.8 73.11 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -177.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -43.11 92.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.779 1.172 . . . . 10.0 110.58 -178.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -74.11 -20.93 60.09 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.712 1.375 . . . . 10.0 114.712 -177.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.32 72.12 2.58 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 118.912 0.778 . . . . 10.0 111.355 178.212 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -62.91 -61.49 0.14 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.846 3.031 . . . . 10.0 115.44 -165.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -68.93 -26.06 64.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.035 0.934 . . . . 10.0 111.694 -178.127 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.38 90.95 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.861 1.264 . . . . 10.0 110.909 166.585 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -76.21 -53.9 7.58 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.266 -0.896 . . . . 10.0 113.299 178.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.56 119.51 15.18 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.952 1.301 . . . . 10.0 109.37 171.167 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.35 -30.71 44.53 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.864 2.376 . . . . 10.0 113.515 -168.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -74.92 70.62 1.75 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.177 0.894 . . . . 10.0 111.625 172.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.6 m -138.84 152.41 47.82 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.997 0.919 . . . . 10.0 111.43 172.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -141.41 12.87 2.16 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.237 1.815 . . . . 10.0 113.327 -178.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.2 ttt -55.03 93.02 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.255 1.822 . . . . 10.0 111.967 165.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.9 mm -71.79 76.65 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 124.812 1.245 . . . . 10.0 110.086 176.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -162.18 -74.09 0.05 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.959 0.726 . . . . 10.0 112.959 176.33 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.73 -67.94 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.443 2.697 . . . . 10.0 116.46 -169.29 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.9 82.1 0.12 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 125.984 1.754 . . . . 10.0 112.653 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 tt -61.43 -43.83 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 123.905 0.882 . . . . 10.0 112.293 -165.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.253 10.8 mtpt 161.45 -78.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 130.938 3.695 . . . . 10.0 110.061 146.026 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -77.0 -83.59 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt 173.69 -43.76 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 128.12 2.568 . . . . 10.0 110.706 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.7 m -50.53 -40.59 52.1 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.334 1.853 . . . . 10.0 112.168 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -59.89 -39.78 86.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.446 0.698 . . . . 10.0 111.072 177.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -51.2 68.19 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.104 1.362 . . . . 10.0 109.881 -179.354 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.07 -26.68 59.54 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -66.66 -43.06 85.56 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.605 1.093 . . . . 10.0 110.916 168.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.35 -35.71 72.36 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.439 1.274 . . . . 10.0 114.439 174.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.36 -55.88 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 172.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -43.9 88.74 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.251 0.621 . . . . 10.0 111.946 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.408 ' CE1' ' HB3' ' A' ' 7' ' ' LYS . 3.0 t80 -52.84 -63.41 1.15 Allowed 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.776 1.23 . . . . 10.0 111.739 170.565 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.23 -30.1 71.17 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.719 1.145 . . . . 10.0 112.334 -174.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -57.69 -32.93 67.85 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.241 1.017 . . . . 10.0 112.497 171.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.5 mmtt -80.62 -53.37 6.6 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 125.065 1.346 . . . . 10.0 111.98 165.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.79 -24.3 34.96 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.319 1.97 . . . . 10.0 116.319 -167.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.5 t -74.14 2.11 9.7 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.126 0.971 . . . . 10.0 113.599 171.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -152.99 -18.55 0.15 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 127.941 2.496 . . . . 10.0 114.981 -179.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.064 2.146 . . . . 10.0 113.316 -171.996 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.55 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 109.266 -1.533 . . . . 10.0 109.266 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.499 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 1.8 m-20 -114.87 -113.56 0.34 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.463 1.505 . . . . 10.0 111.357 -165.397 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -161.51 -59.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 128.39 2.676 . . . . 10.0 107.499 -179.137 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.06 -48.83 75.31 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.398 1.079 . . . . 10.0 112.405 176.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -62.18 -14.89 42.28 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.965 1.098 . . . . 10.0 113.965 172.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.45 -55.8 2.52 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 125.292 1.425 . . . . 10.0 110.032 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 pttt -61.19 -37.48 83.11 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.144 0.972 . . . . 10.0 113.197 -176.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -13.95 60.91 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.216 1.191 . . . . 10.0 114.216 176.578 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.1 mm -103.22 -34.61 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.593 1.157 . . . . 10.0 111.222 169.711 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.67 -53.15 58.61 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.611 0.641 . . . . 10.0 110.793 172.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -66.61 -8.04 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.513 -0.742 . . . . 10.0 112.637 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.84 -50.04 5.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.501 1.92 . . . . 10.0 111.224 -177.078 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -122.82 -1.23 8.94 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -174.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -117.48 -46.2 2.69 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.562 1.145 . . . . 10.0 111.358 -177.355 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.08 -10.75 6.68 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.063 0.764 . . . . 10.0 113.063 168.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -19.02 40.31 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.716 1.606 . . . . 10.0 113.042 166.148 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -143.4 -26.59 0.57 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.537 1.935 . . . . 10.0 115.074 -177.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -110.18 -172.84 2.12 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 128.056 2.542 . . . . 10.0 110.727 179.102 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.7 p -131.16 -82.68 0.52 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.863 1.06 . . . . 10.0 113.863 169.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.294 9.9 p 50.96 -45.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 131.507 3.923 . . . . 10.0 116.502 -169.752 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -72.81 -4.33 30.97 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.096 1.358 . . . . 10.0 112.165 170.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -151.66 173.41 14.71 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.588 1.955 . . . . 10.0 110.031 -166.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.4 64.77 1.71 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.206 1.384 . . . . 10.0 116.512 -163.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.51 0.62 8.48 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.267 2.067 . . . . 10.0 118.267 156.518 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -61.75 73.11 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 128.504 2.722 . . . . 10.0 112.642 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.26 77.18 0.25 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.489 1.138 . . . . 10.0 110.872 167.862 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -73.71 -22.99 59.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.317 2.247 . . . . 10.0 113.538 178.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.6 m -161.2 -28.63 0.05 Allowed 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.548 -0.72 . . . . 10.0 112.904 -174.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -123.12 160.43 17.63 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.828 1.204 . . . . 10.0 111.116 166.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -66.56 6.45 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.742 1 C-N-CA 126.905 5.07 . . . . 10.0 117.378 -162.416 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 61.77 159.74 0.06 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.968 2.107 . . . . 10.0 112.171 -147.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.76 78.35 9.58 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.334 -1.358 . . . . 10.0 107.334 165.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 83.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.467 1.107 . . . . 10.0 110.928 176.748 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.87 -67.66 0.07 OUTLIER Glycine 0 CA--C 1.529 0.936 0 C-N-CA 128.047 2.737 . . . . 10.0 113.158 -178.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.57 -179.84 0.16 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.503 2.721 . . . . 10.0 111.43 -169.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 67.79 82.58 0.17 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.448 1.899 . . . . 10.0 113.504 -174.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.68 -33.69 4.02 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.234 1.873 . . . . 10.0 112.602 169.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -77.62 -168.16 1.12 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.046 1.338 . . . . 10.0 111.576 165.537 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.63 158.5 44.23 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.826 1.25 . . . . 10.0 110.044 -167.87 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -62.25 158.99 15.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 115.357 1.614 . . . . 10.0 115.357 -169.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.65 7.9 38.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.436 1.735 . . . . 10.0 117.436 169.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -100.65 12.35 37.6 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -161.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.42 146.08 89.91 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.031 0.932 . . . . 10.0 113.513 -178.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.63 58.92 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.727 2.951 . . . . 10.0 113.709 178.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 106.96 0.78 36.12 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 125.459 1.504 . . . . 10.0 116.134 168.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.63 132.97 51.23 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.969 1.385 . . . . 10.0 113.266 179.071 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -71.78 84.93 0.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.977 1.711 . . . . 10.0 112.219 175.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.77 175.19 10.31 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.105 1.362 . . . . 10.0 111.478 163.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -69.94 158.61 35.28 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.249 -0.907 . . . . 10.0 110.482 171.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -75.62 -9.32 58.49 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -178.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.16 -77.95 0.21 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.001 0.92 . . . . 10.0 113.162 -170.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.598 ' ND2' ' HG1' ' A' ' 78' ' ' THR . 4.0 p-10 -68.11 -23.81 64.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.828 1.418 . . . . 10.0 114.828 -163.084 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -34.94 79.45 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.672 1.124 . . . . 10.0 113.3 169.501 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.82 -69.11 0.35 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.852 0.751 . . . . 10.0 110.693 162.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -76.92 60.81 1.84 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 10.0 112.414 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -85.09 -162.47 35.65 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.539 1.542 . . . . 10.0 114.637 -177.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.0 pt -169.06 146.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 127.79 2.436 . . . . 10.0 107.945 -166.468 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.0 m -72.59 124.4 25.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.058 1.343 . . . . 10.0 110.302 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.487 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 11.9 m95 -75.41 130.99 39.87 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 123.178 0.591 . . . . 10.0 111.277 175.651 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -164.47 161.49 21.4 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.447 2.299 . . . . 10.0 108.942 -168.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.99 46.82 0.06 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.58 1.952 . . . . 10.0 113.374 176.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -162.35 -62.14 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 129.25 3.02 . . . . 10.0 107.543 -171.171 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 44.5 p -65.99 -29.62 70.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 117.681 -1.152 . . . . 10.0 113.05 -177.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.27 -26.65 60.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.679 1.127 . . . . 10.0 112.908 169.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.2 mtt -65.54 -53.47 41.69 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.824 1.193 . . . . 10.0 108.421 172.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -67.33 -38.94 85.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.68 -0.236 . . . . 10.0 111.006 -176.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -60.72 -63.31 1.34 Allowed 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 119.044 -0.503 . . . . 10.0 111.453 173.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -32.83 74.56 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 120.155 1.343 . . . . 10.0 111.615 -169.941 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.48 -17.64 55.98 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.922 1.453 . . . . 10.0 114.922 175.501 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.09 56.26 0.81 Allowed Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.329 1.452 . . . . 10.0 112.189 -169.574 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.8 -50.92 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.661 2.241 . . . . 10.0 112.772 -159.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -64.27 -24.77 67.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.462 1.905 . . . . 10.0 112.865 -177.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -75.34 -54.13 7.58 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.948 1.299 . . . . 10.0 110.546 167.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -69.54 -30.71 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 -170.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 pt -140.43 118.13 8.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.465 1.106 . . . . 10.0 109.963 163.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.8 151.69 74.17 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.501 2.134 . . . . 10.0 111.484 -176.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.37 5.49 67.33 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 118.726 -1.041 . . . . 10.0 115.223 179.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.598 ' HG1' ' ND2' ' A' ' 52' ' ' ASN . 1.5 t -75.25 -3.56 33.93 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 116.258 1.947 . . . . 10.0 116.258 -170.302 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.2 tptp 59.28 -18.88 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 119.316 3.08 . . . . 10.0 119.316 159.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 19.3 ttt -46.32 114.6 0.83 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.904 2.481 . . . . 10.0 112.058 178.0 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.6 mp -82.43 52.72 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.715 1.206 . . . . 10.0 110.427 -176.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -164.06 150.98 11.7 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.02 1.728 . . . . 10.0 108.939 169.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.28 139.36 5.82 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.424 1.49 . . . . 10.0 108.69 177.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.19 87.88 0.49 Allowed Glycine 0 CA--C 1.529 0.911 0 CA-C-N 118.084 0.402 . . . . 10.0 112.837 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.3 tt -68.51 12.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.977 1.843 . . . . 10.0 115.977 -166.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 59.4 -0.26 0.18 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.881 2.549 . . . . 10.0 117.881 173.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -160.27 104.12 1.46 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.879 2.072 . . . . 10.0 109.199 -168.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -67.67 -13.77 62.37 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.338 1.607 . . . . 10.0 115.338 -177.319 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -62.76 -63.22 1.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.005 0.821 . . . . 10.0 109.323 163.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -50.87 -34.71 29.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.447 1.899 . . . . 10.0 112.814 176.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 91' ' ' ARG . 1.2 tpm_? -51.18 -50.08 59.69 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 174.049 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -75.52 -43.47 48.79 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.952 1.701 . . . . 10.0 110.641 175.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.499 ' CG ' ' H ' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -57.3 -50.13 73.89 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.078 1.751 . . . . 10.0 112.124 -174.226 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -65.79 -38.68 89.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.4 0.546 . . . . 10.0 112.232 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.8 mt -61.38 -48.82 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.414 0.686 . . . . 10.0 109.492 176.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.67 93.85 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.748 1.219 . . . . 10.0 112.868 176.22 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.419 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -50.16 -53.29 28.72 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.023 1.329 . . . . 10.0 111.394 169.651 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 35.8 mt -67.54 -31.58 71.78 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.381 -0.824 . . . . 10.0 112.843 178.534 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -59.61 -26.88 65.82 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.323 1.231 . . . . 10.0 114.323 167.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.494 ' HZ3' ' CD ' ' A' ' 104' ' ' GLU . 0.1 OUTLIER -72.79 -54.36 9.07 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.011 0.823 . . . . 10.0 109.998 162.535 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.19 -25.48 33.02 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.512 1.671 . . . . 10.0 115.512 -175.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.25 5.6 11.89 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.052 1.341 . . . . 10.0 114.161 172.584 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -150.21 -15.63 0.25 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.564 1.946 . . . . 10.0 113.72 -170.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.494 ' CD ' ' HZ3' ' A' ' 100' ' ' LYS . 33.5 mt-10 . . . . . 0 C--O 1.258 1.515 0 C-N-CA 126.873 2.069 . . . . 10.0 110.221 -161.488 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.487 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.286 0 CA-C-O 119.59 -0.561 . . . . 10.0 111.973 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -131.79 122.3 25.57 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.299 1.04 . . . . 10.0 111.134 -157.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -52.82 -55.95 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.012 1.725 . . . . 10.0 111.71 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.8 -44.16 90.71 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 113.646 0.98 . . . . 10.0 113.646 -178.196 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.1 -36.12 72.42 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.156 0.582 . . . . 10.0 110.195 172.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.75 -45.54 16.87 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 124.68 1.133 . . . . 10.0 110.972 -175.029 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -74.95 -29.12 60.85 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -60.86 -53.48 56.78 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.43 1.013 . . . . 10.0 111.051 168.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.9 tp -64.23 -32.28 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 118.787 0.721 . . . . 10.0 112.001 177.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.478 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.7 t80 -59.37 -56.93 15.77 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 118.912 0.778 . . . . 10.0 111.311 170.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.32 -9.06 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 O-C-N 121.633 -0.667 . . . . 10.0 112.713 -178.353 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -63.67 1.25 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.743 1.217 . . . . 10.0 110.501 173.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -113.61 -2.78 13.72 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.774 1.768 . . . . 10.0 115.774 -167.795 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.3 m -103.44 -42.96 5.54 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 124.234 1.014 . . . . 10.0 111.23 171.051 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.01 -9.57 4.54 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.233 1.198 . . . . 10.0 114.233 173.191 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.73 -16.43 63.76 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.226 1.41 . . . . 10.0 112.979 167.855 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -143.54 -33.9 0.42 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.828 1.651 . . . . 10.0 113.928 -177.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -100.76 -178.16 3.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.372 2.269 . . . . 10.0 110.621 173.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.4 t -175.74 117.25 0.15 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.38 1.072 . . . . 10.0 110.771 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.4 p -143.74 -63.64 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.217 1.407 . . . . 10.0 112.761 -173.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -66.45 -32.21 73.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 120.87 1.668 . . . . 10.0 110.507 170.153 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -68.05 120.74 14.78 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.745 1.218 . . . . 10.0 109.065 156.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.81 65.16 1.84 Allowed Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.91 0.767 . . . . 10.0 112.914 174.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.91 -146.24 13.04 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.226 1.393 . . . . 10.0 114.376 -175.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 pttp -161.68 69.77 0.32 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.683 1.593 . . . . 10.0 112.061 -167.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p80 34.28 80.72 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.337 2.655 . . . . 10.0 115.08 163.753 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -68.53 -47.94 65.62 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.011 1.725 . . . . 10.0 112.944 -168.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -152.51 -23.49 0.17 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.424 1.49 . . . . 10.0 111.923 -166.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -119.71 -178.94 16.51 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 126.3 1.905 . . . . 10.0 108.934 155.462 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -72.84 -176.45 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 CA-C-N 120.03 1.915 . . . . 10.0 111.251 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -64.42 -35.92 82.48 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 179.342 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp 67.53 68.48 0.37 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.832 2.853 . . . . 10.0 111.006 -150.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.88 73.71 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.47 1.908 . . . . 10.0 112.619 161.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.58 -67.48 0.41 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 127.402 2.429 . . . . 10.0 114.706 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 54.1 -163.79 0.11 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.116 2.166 . . . . 10.0 113.084 -169.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 67.86 10.14 7.59 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.105 2.562 . . . . 10.0 114.743 -176.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -160.17 13.06 0.18 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.787 1.66 . . . . 10.0 114.16 -179.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.51 169.29 24.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.826 1.25 . . . . 10.0 111.943 -177.194 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -65.04 163.28 15.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.85 1.66 . . . . 10.0 112.564 179.245 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.4 p -69.82 164.58 23.34 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.414 0.686 . . . . 10.0 110.957 170.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.46 -112.76 3.78 Favored Glycine 0 N--CA 1.47 0.938 0 CA-C-O 118.193 -1.337 . . . . 10.0 115.68 169.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 38.37 2.41 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 1 C-N-CA 132.02 4.128 . . . . 10.0 121.104 178.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -44.89 104.25 0.38 Allowed Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 127.653 2.381 . . . . 10.0 114.814 -178.612 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.91 50.73 3.57 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 123.778 2.985 . . . . 10.0 113.217 -172.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.69 49.75 0.1 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.573 1.558 . . . . 10.0 113.853 176.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -148.97 118.0 6.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.257 1.023 . . . . 10.0 110.868 176.327 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.3 m -72.34 118.04 14.74 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.857 1.663 . . . . 10.0 111.088 176.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.631 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -127.89 177.19 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.371 1.868 . . . . 10.0 112.337 -175.639 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.6 p -77.65 142.66 38.73 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.282 -0.886 . . . . 10.0 111.788 168.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -65.11 -171.96 0.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.207 2.203 . . . . 10.0 112.769 163.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 59.1 -67.13 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.445 2.698 . . . . 10.0 112.093 -166.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -47.77 -31.73 5.17 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 130.209 3.404 . . . . 10.0 113.769 -179.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.631 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 27.4 mtmm -158.7 4.3 0.1 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 129.029 2.931 . . . . 10.0 112.467 -162.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.71 -62.48 1.37 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.672 0.789 . . . . 10.0 111.098 138.026 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -19.74 58.58 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.304 1.442 . . . . 10.0 114.812 -163.785 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.28 28.05 46.13 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-O 117.471 -1.738 . . . . 10.0 116.358 161.559 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 pp -54.98 20.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 130.346 3.458 . . . . 10.0 119.801 -167.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.2 m 55.64 99.27 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 128.865 2.866 . . . . 10.0 115.033 177.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.452 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 11.3 m95 -70.47 124.46 24.25 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.606 -0.684 . . . . 10.0 111.238 167.169 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt -163.86 170.18 17.18 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 129.565 3.146 . . . . 10.0 107.82 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -56.13 -33.61 65.33 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -60.86 -65.28 0.72 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.454 1.102 . . . . 10.0 111.887 171.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.0 p -62.69 -39.51 94.2 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.637 1.175 . . . . 10.0 111.981 -175.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.67 -16.99 59.39 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 174.954 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 29.0 mtm -68.27 -60.42 2.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.629 1.104 . . . . 10.0 108.741 160.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.63 -43.85 72.64 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.872 0.733 . . . . 10.0 111.006 -175.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -64.8 -54.97 22.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.151 -0.928 . . . . 10.0 113.07 178.038 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -26.09 65.37 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.741 1.61 . . . . 10.0 113.644 -178.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.46 -36.45 79.01 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.933 1.242 . . . . 10.0 112.614 171.153 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -161.58 96.01 1.3 Allowed Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.721 1.146 . . . . 10.0 112.594 169.638 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.67 -44.11 0.76 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.416 2.077 . . . . 10.0 111.098 -167.237 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -71.66 -24.08 61.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.092 1.757 . . . . 10.0 114.342 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -75.99 -40.11 54.47 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.886 1.221 . . . . 10.0 112.469 162.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -68.27 -41.06 81.62 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.258 0.836 . . . . 10.0 113.258 -176.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.47 156.96 69.29 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.244 1.018 . . . . 10.0 111.967 169.29 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.02 164.95 24.56 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.158 2.572 . . . . 10.0 114.833 -172.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.52 -77.43 0.09 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 127.157 2.313 . . . . 10.0 112.082 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m 58.8 -40.65 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 130.297 3.439 . . . . 10.0 118.954 164.266 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt 55.49 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 117.85 2.537 . . . . 10.0 117.85 174.629 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -64.59 79.52 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.054 1.742 . . . . 10.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tp -70.56 79.51 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.905 1.682 . . . . 10.0 111.395 178.096 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -161.12 -60.6 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 117.873 -1.061 . . . . 10.0 113.561 -176.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.14 91.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.931 2.197 . . . . 10.0 116.931 172.069 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.58 105.53 1.94 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 124.354 0.978 . . . . 10.0 111.285 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.5 tt -62.92 -56.3 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.439 0.903 . . . . 10.0 113.439 -165.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -162.34 -66.27 0.05 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.537 1.935 . . . . 10.0 111.111 174.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.9 mtmt -161.67 169.85 20.81 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.693 2.397 . . . . 10.0 107.886 -162.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -75.38 -11.35 60.03 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 -167.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.6 m -75.6 -56.17 4.95 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.942 1.247 . . . . 10.0 109.418 169.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -53.83 -36.79 62.93 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.819 2.047 . . . . 10.0 111.329 178.378 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -53.73 -46.11 70.74 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 126.833 2.053 . . . . 10.0 114.188 171.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -73.14 -45.12 58.55 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.112 0.965 . . . . 10.0 110.587 173.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -56.77 -49.23 75.92 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.781 1.232 . . . . 10.0 111.312 -170.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.1 -50.28 73.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.602 1.161 . . . . 10.0 112.538 174.365 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.8 mm -58.09 -47.18 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.182 0.993 . . . . 10.0 109.733 177.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.21 -47.32 85.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.585 1.154 . . . . 10.0 111.864 177.736 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -56.14 -56.79 16.61 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 118.661 -0.685 . . . . 10.0 112.081 173.375 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.69 -33.37 74.78 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.237 0.926 . . . . 10.0 112.484 -174.682 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -70.97 -23.58 62.24 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.381 1.252 . . . . 10.0 114.381 174.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -73.34 -59.23 2.81 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.687 -1.149 . . . . 10.0 110.825 159.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.86 -22.61 38.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 115.671 1.73 . . . . 10.0 115.671 -169.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 t -76.63 4.21 9.91 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.342 1.457 . . . . 10.0 114.582 169.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -150.37 -32.98 0.18 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.251 2.22 . . . . 10.0 112.925 -170.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 . . . . . 0 C--O 1.251 1.135 0 C-N-CA 127.595 2.358 . . . . 10.0 110.149 -156.93 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.452 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.433 ' H1 ' ' HB3' ' A' ' 93' ' ' ASP . . . . . . . . 0 N--CA 1.47 0.963 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.988 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -156.67 170.94 21.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.941 1.371 . . . . 10.0 110.367 161.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.4 t -70.08 -67.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 126.267 1.827 . . . . 10.0 109.842 172.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -37.97 89.37 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.78 1.232 . . . . 10.0 112.509 179.74 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 mttp -73.17 4.56 4.31 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 118.094 -0.955 . . . . 10.0 113.422 168.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.63 -32.44 3.38 Favored Glycine 0 N--CA 1.472 1.036 0 CA-C-N 119.832 1.197 . . . . 10.0 114.505 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -29.72 65.4 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.791 1.796 . . . . 10.0 112.429 169.917 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.06 -15.73 63.31 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.372 1.619 . . . . 10.0 115.372 179.039 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.446 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 10.9 tp -110.46 -32.16 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.82 1.248 . . . . 10.0 111.252 170.375 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -54.61 -54.92 35.02 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 118.567 0.621 . . . . 10.0 110.088 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.32 -9.84 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.898 0.879 . . . . 10.0 112.673 -178.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -99.45 -35.81 9.78 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.26 1.824 . . . . 10.0 112.869 -173.348 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.42 -57.73 2.04 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.3 1.04 . . . . 10.0 111.709 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -56.52 -48.91 76.21 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.343 1.057 . . . . 10.0 112.24 -176.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.84 3.2 3.43 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.924 1.453 . . . . 10.0 114.924 174.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.37 -11.69 61.08 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 120.169 1.35 . . . . 10.0 111.854 162.089 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.18 -47.13 0.35 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.402 1.481 . . . . 10.0 112.33 -174.538 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -88.77 -170.71 3.03 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 127.194 2.197 . . . . 10.0 111.751 176.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.454 HG21 ' H ' ' A' ' 20' ' ' VAL . 5.1 t -131.52 -76.49 0.52 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.774 1.23 . . . . 10.0 113.666 -178.388 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.454 ' H ' HG21 ' A' ' 19' ' ' THR . 31.0 t 59.06 -60.46 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 129.925 3.29 . . . . 10.0 113.87 -174.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -128.35 -23.99 3.16 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 128.421 2.688 . . . . 10.0 110.52 -173.019 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -77.36 72.41 3.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.149 1.38 . . . . 10.0 110.681 168.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.39 -86.38 0.02 OUTLIER Glycine 0 CA--C 1.534 1.27 0 C-N-CA 127.597 2.522 . . . . 10.0 115.613 169.797 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.1 104.08 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 124.255 0.931 . . . . 10.0 112.244 -178.267 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -164.26 159.71 20.3 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.289 1.836 . . . . 10.0 112.225 178.687 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -157.3 108.96 2.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.066 1.746 . . . . 10.0 107.746 175.69 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -141.58 127.77 19.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.441 2.296 . . . . 10.0 107.747 -169.133 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.1 m 56.36 -26.8 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 127.73 2.412 . . . . 10.0 115.74 -169.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.02 172.48 17.13 Favored Glycine 0 CA--C 1.544 1.889 0 C-N-CA 127.336 2.398 . . . . 10.0 111.885 160.549 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -75.87 -128.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.692 4.262 . . . . 10.0 110.725 175.596 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -144.76 -173.36 4.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.341 1.857 . . . . 10.0 109.784 -178.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.14 65.18 1.4 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 122.445 1.116 . . . . 10.0 109.497 175.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.31 77.06 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.16 2.584 . . . . 10.0 112.483 164.525 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.49 -58.31 0.3 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 128.976 3.179 . . . . 10.0 112.505 -172.387 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.263 0.1 OUTLIER 48.19 -106.54 0.17 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.658 2.383 . . . . 10.0 111.378 -165.516 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.327 9.6 m-85 33.86 39.7 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.171 2.988 . . . . 10.0 117.258 171.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 131.81 -16.08 5.08 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 126.82 2.153 . . . . 10.0 115.801 -175.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -64.23 -88.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.448 2.124 . . . . 10.0 113.967 -176.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.01 168.53 3.46 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 128.365 2.666 . . . . 10.0 111.641 163.159 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.7 p -67.53 163.26 21.52 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.448 2.299 . . . . 10.0 113.994 -177.755 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.75 9.37 81.21 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 117.979 1.952 . . . . 10.0 117.979 145.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -96.53 139.27 32.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.723 1.762 . . . . 10.0 113.199 -174.387 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.8 152.13 11.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.862 2.065 . . . . 10.0 108.741 160.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.24 67.97 8.43 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.987 2.458 . . . . 10.0 111.325 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.76 4.26 51.99 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 116.338 1.295 . . . . 10.0 116.338 169.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -70.1 175.04 4.79 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 119.173 1.486 . . . . 10.0 111.466 166.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -152.71 137.48 17.03 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.849 -1.157 . . . . 10.0 112.101 -174.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -156.66 169.42 24.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.591 2.356 . . . . 10.0 111.032 -153.715 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.8 p -64.86 122.95 18.14 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.026 0.83 . . . . 10.0 112.333 -172.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -35.55 71.28 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.716 1.376 . . . . 10.0 114.716 -159.495 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.73 -27.89 68.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -179.107 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -58.31 -62.66 1.67 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.082 0.953 . . . . 10.0 111.339 -175.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.79 -54.88 7.3 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.869 1.667 . . . . 10.0 110.189 177.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -65.96 -30.62 71.22 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.327 1.851 . . . . 10.0 114.51 -177.022 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -22.4 66.26 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 117.237 -1.363 . . . . 10.0 113.493 -179.135 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.04 -10.95 2.17 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 118.011 1.964 . . . . 10.0 118.011 154.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -15.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 128.521 2.728 . . . . 10.0 115.653 -178.28 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.9 m 58.39 128.48 0.01 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 131.201 3.8 . . . . 10.0 113.932 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.431 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 48.9 m95 -69.34 123.15 20.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.182 -0.917 . . . . 10.0 111.058 -177.882 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.96 176.53 9.31 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 127.247 2.219 . . . . 10.0 109.466 -177.313 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -47.24 -26.87 1.31 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.79 2.836 . . . . 10.0 114.771 178.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -74.26 -71.27 0.34 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 10.0 112.519 167.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 56.8 p -75.37 -36.03 61.02 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 128.544 2.737 . . . . 10.0 112.074 -158.478 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.68 -21.28 59.49 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.571 1.148 . . . . 10.0 111.504 175.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.5 ttm -64.47 -53.95 40.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.153 0.581 . . . . 10.0 109.51 168.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -63.22 -46.89 84.89 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.595 0.559 . . . . 10.0 110.681 178.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.9 -48.04 72.79 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 113.331 0.863 . . . . 10.0 113.331 -174.314 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -17.93 59.79 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.638 1.563 . . . . 10.0 114.122 175.331 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -72.46 -33.3 66.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.989 1.722 . . . . 10.0 113.696 164.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.74 110.5 0.95 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 120.164 1.347 . . . . 10.0 113.713 158.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.19 -44.01 0.48 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.753 1.635 . . . . 10.0 112.174 -167.607 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.1 mtmp? -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.74 2.416 . . . . 10.0 113.259 178.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -70.55 -54.6 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.294 1.438 . . . . 10.0 109.368 172.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -72.81 -32.15 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.777 1.029 . . . . 10.0 113.777 -166.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 14.6 pt -137.11 143.89 43.85 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.069 0.948 . . . . 10.0 110.656 173.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.64 74.47 5.44 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.372 2.714 . . . . 10.0 112.941 -165.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.13 -100.72 0.18 Allowed Glycine 0 CA--C 1.524 0.611 0 C-N-CA 124.43 1.014 . . . . 10.0 111.554 166.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.8 m 51.04 93.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.03 2.532 . . . . 10.0 115.737 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -64.55 16.07 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 128.125 2.57 . . . . 10.0 115.271 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.5 ttt -69.76 90.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.302 1.441 . . . . 10.0 111.143 -178.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.34 69.58 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.607 1.963 . . . . 10.0 111.591 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -163.73 -42.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.943 1.697 . . . . 10.0 111.806 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.32 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 120.89 3.663 . . . . 10.0 120.89 178.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -166.39 147.09 11.61 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 121.427 1.922 . . . . 10.0 111.345 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.269 12.2 tt -71.23 -68.02 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.19 1.552 . . . . 10.0 115.19 -165.221 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.3 tttm -176.85 -51.25 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.156 1.782 . . . . 10.0 112.487 -179.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.449 ' HE3' ' HB ' ' A' ' 89' ' ' THR . 28.3 ttpt -164.24 146.87 9.12 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.947 2.099 . . . . 10.0 107.628 -160.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -58.84 -32.33 69.32 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 -176.146 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.449 ' HB ' ' HE3' ' A' ' 87' ' ' LYS . 4.9 m -61.67 -34.02 75.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.172 0.804 . . . . 10.0 113.172 174.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -76.3 -37.14 57.89 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.587 0.63 . . . . 10.0 111.73 171.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -55.15 -45.47 75.67 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.911 -1.118 . . . . 10.0 111.679 172.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -56.1 -53.89 51.58 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.623 1.169 . . . . 10.0 111.673 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.433 ' HB3' ' H1 ' ' A' ' 1' ' ' GLY . 2.2 p30 -60.21 -34.87 74.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.528 0.731 . . . . 10.0 112.804 -169.079 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.49 -44.72 90.1 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.162 -0.961 . . . . 10.0 112.99 172.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.65 -46.82 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 109.158 -0.682 . . . . 10.0 109.158 177.624 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.76 -55.58 32.37 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.782 0.833 . . . . 10.0 111.903 173.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -50.68 -60.82 2.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.353 1.861 . . . . 10.0 112.505 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.9 -20.21 58.21 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.365 1.246 . . . . 10.0 114.365 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.415 ' HE3' ' HA ' ' A' ' 99' ' ' LYS . 0.6 OUTLIER -67.32 -29.35 68.89 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.166 1.348 . . . . 10.0 112.271 168.324 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -69.76 -39.73 76.53 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 117.674 -1.155 . . . . 10.0 112.24 165.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.86 -9.0 2.48 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 116.22 1.933 . . . . 10.0 116.22 -178.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.634 ' HG1' ' ND2' ' A' ' 103' ' ' ASN . 22.7 p -94.59 7.36 45.95 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.96 1.304 . . . . 10.0 114.016 167.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.634 ' ND2' ' HG1' ' A' ' 102' ' ' THR . 69.3 m-80 -150.68 -15.42 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.322 1.449 . . . . 10.0 113.495 -163.167 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 C--O 1.255 1.367 0 C-N-CA 130.21 3.404 . . . . 10.0 107.964 179.716 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.431 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 CA-C-O 119.71 -0.494 . . . . 10.0 112.356 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -86.94 103.13 15.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.221 1.408 . . . . 10.0 111.825 -163.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.7 m -60.54 -16.0 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 114.161 1.171 . . . . 10.0 114.161 -175.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -69.59 -59.6 2.86 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.873 2.069 . . . . 10.0 111.693 167.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -53.75 -27.79 30.69 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.842 0.857 . . . . 10.0 112.254 170.252 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.18 -47.76 12.46 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.699 1.142 . . . . 10.0 111.863 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.89 -39.9 79.51 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.397 1.099 . . . . 10.0 112.231 177.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -40.6 81.5 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.739 -1.6 . . . . 10.0 111.504 178.285 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.5 -33.61 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 121.559 1.981 . . . . 10.0 111.062 173.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -57.18 -53.78 54.24 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 118.854 0.752 . . . . 10.0 110.425 170.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.52 -10.34 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 N-CA-C 113.677 0.992 . . . . 10.0 113.677 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -96.81 -38.28 9.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.66 1.984 . . . . 10.0 111.598 -176.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -125.66 -17.35 5.51 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 115.031 1.493 . . . . 10.0 115.031 -172.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.0 m -112.49 -39.88 4.25 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 125.07 1.348 . . . . 10.0 112.235 -172.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.07 -17.31 9.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.743 0.645 . . . . 10.0 112.743 170.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.36 -29.07 32.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.061 1.744 . . . . 10.0 113.052 166.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.7 m -145.34 11.3 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 126.52 1.928 . . . . 10.0 114.983 -177.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -149.38 -178.3 6.34 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.106 1.321 . . . . 10.0 111.385 -177.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -150.91 172.76 15.16 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.357 -1.464 . . . . 10.0 108.071 151.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -166.09 -41.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.623 1.569 . . . . 10.0 111.869 162.365 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.81 82.71 0.11 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.729 0.812 . . . . 10.0 109.181 172.081 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 56.41 -174.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.883 2.073 . . . . 10.0 111.206 -166.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.59 29.46 63.98 Favored Glycine 0 CA--C 1.54 1.613 0 N-CA-C 116.956 1.543 . . . . 10.0 116.956 170.373 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.22 127.4 38.93 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 119.15 1.475 . . . . 10.0 112.556 175.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -163.32 8.39 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.685 1.735 . . . . 10.0 115.685 -171.171 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 63.74 -70.35 0.07 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.201 3.001 . . . . 10.0 111.742 -177.93 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 43.02 97.57 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 130.485 3.514 . . . . 10.0 114.157 175.019 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.0 m 58.23 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 127.782 2.433 . . . . 10.0 116.123 -169.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.09 -176.4 14.4 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 120.168 1.349 . . . . 10.0 113.842 174.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.39 -2.59 12.63 Favored 'Trans proline' 0 CA--C 1.536 0.585 1 C-N-CA 125.978 4.452 . . . . 10.0 115.885 -175.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.421 0.1 OUTLIER 43.56 158.0 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.847 2.859 . . . . 10.0 117.336 -154.818 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.38 24.42 1.16 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 119.749 -1.844 . . . . 10.0 113.875 -167.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.454 ' CD2' HE21 ' A' ' 42' ' ' GLN . 0.2 OUTLIER -57.28 98.96 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 130.001 3.32 . . . . 10.0 114.436 -166.334 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.53 7.72 61.55 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.468 1.033 . . . . 10.0 114.378 176.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.49 178.4 0.42 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.115 1.458 . . . . 10.0 110.569 168.672 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.25 18.0 m-85 63.69 26.2 14.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 10.0 113.939 -159.068 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 176.61 15.11 0.02 OUTLIER Glycine 0 CA--C 1.536 1.39 0 C-N-CA 126.141 1.829 . . . . 10.0 114.716 -175.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -153.15 160.26 42.83 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.074 1.437 . . . . 10.0 111.304 -168.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.5 pttm -81.05 160.1 24.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.609 1.564 . . . . 10.0 112.762 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 t -58.47 150.07 23.54 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.082 -0.386 . . . . 10.0 110.354 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.24 63.6 0.8 Allowed Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.261 0.934 . . . . 10.0 112.138 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.454 HE21 ' CD2' ' A' ' 33' ' ' HIS . 13.3 pt20 -154.21 -19.49 0.13 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -177.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 136.15 96.59 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 119.169 0.895 . . . . 10.0 112.163 -168.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.91 72.96 5.0 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.631 2.887 . . . . 10.0 113.074 -168.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.01 2.37 52.24 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.77 1.468 . . . . 10.0 116.77 165.171 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.64 155.16 34.22 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 119.178 1.489 . . . . 10.0 111.163 175.433 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 m -71.72 74.87 0.84 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.341 1.456 . . . . 10.0 113.42 -176.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -83.67 172.88 11.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.752 1.621 . . . . 10.0 111.935 166.2 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.9 p -77.3 172.98 12.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 121.254 -0.904 . . . . 10.0 111.526 167.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -69.23 -63.28 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.095 -1.003 . . . . 10.0 111.392 169.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.8 -39.46 65.49 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.899 1.28 . . . . 10.0 113.92 -160.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -61.86 -38.44 88.25 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.678 0.791 . . . . 10.0 112.942 178.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -77.19 -51.28 11.23 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.528 1.931 . . . . 10.0 110.701 173.834 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.36 -30.91 71.79 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.069 2.147 . . . . 10.0 113.32 -174.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 mmmm -159.99 16.58 0.14 Allowed 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.135 0.974 . . . . 10.0 113.391 -153.343 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.63 -133.61 0.67 Allowed Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.335 0.969 . . . . 10.0 111.878 163.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -170.23 -178.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.977 1.711 . . . . 10.0 110.521 -157.226 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 m -74.46 119.62 18.9 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.522 1.529 . . . . 10.0 111.194 172.437 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -77.14 62.07 2.16 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.461 1.504 . . . . 10.0 110.991 169.205 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -78.27 0.18 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 131.321 3.848 . . . . 10.0 115.643 -172.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 179.46 -9.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.992 2.917 . . . . 10.0 114.415 -176.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -81.82 -64.63 1.14 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.519 1.963 . . . . 10.0 112.857 160.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.8 p -54.74 -35.79 64.11 Favored 'General case' 0 N--CA 1.467 0.388 1 C-N-CA 132.078 4.151 . . . . 10.0 114.913 -165.613 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.6 mp -69.99 -24.56 63.33 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 117.606 -1.187 . . . . 10.0 113.103 175.327 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -41.91 68.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 120.55 1.523 . . . . 10.0 109.425 175.741 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -46.61 78.33 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.418 -0.513 . . . . 10.0 110.336 172.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -67.64 -43.6 79.93 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.711 1.004 . . . . 10.0 113.711 -174.712 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.35 -34.36 74.47 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.884 1.675 . . . . 10.0 112.572 177.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -76.36 -25.77 55.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.494 0.718 . . . . 10.0 112.694 177.147 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.58 74.63 2.11 Favored Pre-proline 0 CA--C 1.559 1.296 0 N-CA-C 113.275 0.842 . . . . 10.0 113.275 -178.25 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.29 -50.13 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.887 2.391 . . . . 10.0 112.487 -166.678 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -66.85 -22.26 65.99 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.798 1.639 . . . . 10.0 113.689 -178.747 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -75.41 -53.33 8.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.327 1.051 . . . . 10.0 110.274 166.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.34 -38.46 91.22 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.465 0.913 . . . . 10.0 113.465 -172.601 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.0 pt -131.69 117.72 16.48 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.773 0.829 . . . . 10.0 110.767 171.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.19 104.37 1.66 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.574 2.85 . . . . 10.0 111.798 -172.1 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.68 82.31 1.62 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.032 0.825 . . . . 10.0 111.594 178.189 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -133.22 -19.38 2.2 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.253 1.946 . . . . 10.0 116.253 -169.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 55.47 2.29 0.06 Allowed 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 117.039 2.236 . . . . 10.0 117.039 173.461 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.2 ttt -62.93 81.45 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 120.302 1.41 . . . . 10.0 110.081 161.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.49 90.26 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.956 1.303 . . . . 10.0 109.359 176.063 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -161.6 -68.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 118.32 -0.848 . . . . 10.0 112.825 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.17 89.08 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 127.237 2.215 . . . . 10.0 116.527 172.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.38 92.56 2.05 Favored Glycine 0 CA--C 1.532 1.101 0 O-C-N 121.691 -0.631 . . . . 10.0 113.179 175.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 17.8 tt -64.38 -36.82 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 115.808 1.781 . . . . 10.0 115.808 -167.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttm 164.41 -165.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 129.413 3.085 . . . . 10.0 108.501 -161.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.426 ' HE2' ' HG2' ' A' ' 90' ' ' GLU . 40.8 pttt -52.63 153.32 3.19 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.973 1.709 . . . . 10.0 110.91 167.088 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -73.16 71.45 1.16 Allowed 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 123.325 1.536 . . . . 10.0 110.774 171.656 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.3 m -151.89 -54.34 0.13 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 125.903 1.681 . . . . 10.0 108.259 169.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HG2' ' HE2' ' A' ' 87' ' ' LYS . 18.6 mm-40 -56.7 -38.83 72.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.762 0.71 . . . . 10.0 111.313 172.47 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -30.98 71.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.153 0.581 . . . . 10.0 111.907 174.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.05 -36.08 61.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.068 0.947 . . . . 10.0 111.239 173.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.59 -48.08 70.69 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.646 1.978 . . . . 10.0 111.186 175.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.23 -53.91 30.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.949 2.1 . . . . 10.0 112.668 174.681 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.26 -38.88 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 122.781 0.432 . . . . 10.0 110.274 -178.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.7 99.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 122.525 0.33 . . . . 10.0 111.647 173.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -56.6 -60.85 2.93 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.476 1.11 . . . . 10.0 111.195 172.287 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.04 -36.78 80.48 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.543 1.065 . . . . 10.0 112.728 -175.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.91 -32.57 61.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 117.891 -1.052 . . . . 10.0 112.721 174.478 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -101.13 -35.79 9.19 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 175.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.61 -27.53 64.77 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.969 1.713 . . . . 10.0 113.506 -178.262 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.9 t -65.38 -11.65 44.4 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.835 1.254 . . . . 10.0 114.363 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.71 51.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.031 2.132 . . . . 10.0 111.029 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 113.388 0.885 . . . . 10.0 113.388 172.026 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.29 119.88 19.25 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.814 1.246 . . . . 10.0 110.501 -161.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -56.24 -34.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 O-C-N 121.48 -0.763 . . . . 10.0 111.294 172.482 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.2 mp0 -60.72 -48.02 83.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 126.528 1.931 . . . . 10.0 111.164 -171.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mtmp? -75.68 -23.64 56.23 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.069 1.748 . . . . 10.0 113.568 167.579 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.27 -46.42 7.54 Favored Glycine 0 N--CA 1.464 0.555 0 O-C-N 121.236 -0.915 . . . . 10.0 111.78 -168.54 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -41.48 50.79 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.923 1.289 . . . . 10.0 113.408 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -71.72 -37.86 70.57 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.709 -1.139 . . . . 10.0 113.763 179.228 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.27 -35.61 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 120.372 1.442 . . . . 10.0 109.996 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 32.6 t80 -57.08 -51.11 70.61 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.222 0.919 . . . . 10.0 110.624 173.606 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.22 -16.63 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 113.968 1.099 . . . . 10.0 113.968 177.033 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.2 -34.76 25.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.535 1.134 . . . . 10.0 111.953 -173.768 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -136.53 -58.95 0.73 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.799 1.639 . . . . 10.0 110.334 -163.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 8.9 m -58.45 -45.9 87.64 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.806 1.243 . . . . 10.0 111.999 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -8.78 17.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.713 1.375 . . . . 10.0 114.713 175.497 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -10.22 59.48 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.01 -1.056 . . . . 10.0 112.412 169.774 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 87.3 m -142.87 -27.55 0.58 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -173.024 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -116.72 168.12 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.333 2.253 . . . . 10.0 112.956 -176.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -136.07 137.78 41.45 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.859 1.263 . . . . 10.0 109.855 165.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.2 p -166.26 -32.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.923 1.289 . . . . 10.0 111.738 172.364 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -48.21 -38.06 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.36 2.264 . . . . 10.0 115.311 175.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.46 148.47 16.38 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.489 1.916 . . . . 10.0 108.14 168.346 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 -143.21 48.35 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-O 121.583 0.546 . . . . 10.0 112.05 -172.336 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.5 118.21 0.53 Allowed Glycine 0 CA--C 1.527 0.806 0 C-N-CA 125.084 1.326 . . . . 10.0 111.575 -176.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -164.33 167.78 19.41 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.376 2.27 . . . . 10.0 109.008 178.786 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.89 148.94 28.4 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 121.349 -0.844 . . . . 10.0 111.689 -173.767 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -143.91 -34.82 0.38 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.119 1.768 . . . . 10.0 113.399 -174.172 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -150.9 -21.17 0.22 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.433 0.693 . . . . 10.0 111.604 -169.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.97 167.06 22.97 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 109.782 -1.327 . . . . 10.0 109.782 149.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.0 155.49 52.78 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 10.0 112.135 179.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.69 129.68 40.73 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.068 -1.02 . . . . 10.0 109.82 165.543 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.32 70.36 2.92 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.571 1.653 . . . . 10.0 112.592 -167.311 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.65 88.61 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.583 1 C-N-CA 132.576 4.35 . . . . 10.0 115.112 -178.931 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.58 27.23 70.62 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.245 0.926 . . . . 10.0 114.938 162.652 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.5 mp -53.37 166.06 0.31 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.834 1.654 . . . . 10.0 111.905 178.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 29.1 m-85 65.36 59.37 0.8 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.007 1.723 . . . . 10.0 113.246 -174.067 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 161.35 -46.01 0.38 Allowed Glycine 0 CA--C 1.53 0.986 0 CA-C-N 115.533 -0.758 . . . . 10.0 114.187 167.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.11 169.51 13.06 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.976 0.91 . . . . 10.0 112.13 177.086 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.1 pttm -74.74 -20.52 59.79 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 115.055 1.502 . . . . 10.0 115.055 -165.828 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.435 HG21 ' CD1' ' A' ' 59' ' ' TRP 0.288 29.6 p 88.05 167.5 0.06 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 129.417 3.087 . . . . 10.0 112.659 175.449 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 70.21 116.77 0.04 OUTLIER Glycine 0 CA--C 1.541 1.664 0 C-N-CA 123.109 0.385 . . . . 10.0 112.217 -154.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -159.45 4.87 0.09 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.393 1.877 . . . . 10.0 113.861 168.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -50.86 108.98 1.16 Allowed Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 125.966 1.707 . . . . 10.0 114.651 -164.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.6 65.61 8.09 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.386 3.391 . . . . 10.0 112.944 -171.459 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 107.64 60.26 0.56 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.798 1.19 . . . . 10.0 113.171 174.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -143.81 169.66 17.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.182 1.393 . . . . 10.0 109.607 177.286 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -153.25 151.79 30.44 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.585 0.754 . . . . 10.0 110.772 177.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.76 -92.89 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 10.0 111.22 -153.899 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -145.8 -1.64 0.77 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.129 2.172 . . . . 10.0 114.106 -177.006 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 45.46 -95.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.923 2.089 . . . . 10.0 112.613 -157.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 30.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.697 3.199 . . . . 10.0 115.558 170.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -43.95 -56.61 3.82 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.782 2.033 . . . . 10.0 111.695 174.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.01 -40.09 94.49 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.263 1.825 . . . . 10.0 111.087 -177.397 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -63.41 -48.6 77.13 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.227 1.411 . . . . 10.0 111.533 176.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -62.18 -24.09 66.99 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.714 1.206 . . . . 10.0 113.701 -174.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.4 36.66 93.68 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.375 0.989 . . . . 10.0 114.184 171.083 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -1.44 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.869 2.067 . . . . 10.0 116.084 -174.486 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.8 m 56.27 92.59 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.606 1.963 . . . . 10.0 113.184 -179.689 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.632 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 10.5 m95 -58.68 125.75 24.75 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.427 168.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 0.6 OUTLIER -162.76 178.62 8.31 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.782 2.833 . . . . 10.0 109.177 -178.237 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -67.17 35.36 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 129.637 3.175 . . . . 10.0 114.574 -172.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -160.89 -63.8 0.06 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 127.904 2.482 . . . . 10.0 108.432 -174.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.5 p -57.92 -46.93 84.25 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.116 1.366 . . . . 10.0 111.673 179.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.44 -29.09 66.72 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.563 1.145 . . . . 10.0 111.783 175.519 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 30.3 ttm -68.77 -43.69 75.24 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 118.275 0.489 . . . . 10.0 111.105 175.663 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -67.91 -45.79 73.37 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 117.908 0.322 . . . . 10.0 110.184 173.305 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.5 -57.72 11.53 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 118.107 -0.949 . . . . 10.0 112.45 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -34.05 76.72 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.549 1.522 . . . . 10.0 111.904 -174.573 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -73.02 -22.05 60.72 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.634 1.716 . . . . 10.0 115.634 175.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -161.47 63.15 1.61 Allowed Pre-proline 0 CA--C 1.556 1.189 0 CA-C-N 120.156 1.344 . . . . 10.0 114.384 178.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.208 1.939 . . . . 10.0 113.072 -159.18 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -71.17 -20.47 62.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.703 2.001 . . . . 10.0 112.745 -178.248 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.23 -51.99 10.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.521 1.129 . . . . 10.0 110.231 164.149 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -60.49 -44.99 95.37 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.87 1.063 . . . . 10.0 113.87 -173.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 pt -137.08 124.35 14.07 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.992 . . . . 10.0 110.436 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -78.07 60.24 7.28 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.407 3.405 . . . . 10.0 112.696 -167.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.85 66.38 0.04 OUTLIER Glycine 0 CA--C 1.523 0.584 0 O-C-N 121.567 -0.708 . . . . 10.0 113.338 179.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 4.5 m -135.91 125.35 25.0 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.886 0.874 . . . . 10.0 111.871 173.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -86.39 -3.53 59.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.783 1.401 . . . . 10.0 114.783 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.1 ttt -50.11 101.83 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.972 1.709 . . . . 10.0 113.7 -174.816 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 27.3 mm -78.22 72.96 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.224 1.41 . . . . 10.0 109.583 175.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -163.58 -49.42 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.851 1.26 . . . . 10.0 111.139 169.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.93 32.53 1.35 Allowed 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 118.081 2.623 . . . . 10.0 118.081 164.52 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 179.0 -161.11 27.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.965 1.269 . . . . 10.0 111.441 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.2 tt -147.68 -175.37 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.554 0.742 . . . . 10.0 111.71 165.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -77.89 -30.47 50.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.939 1.296 . . . . 10.0 114.492 -164.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -161.63 -68.96 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 116.588 -1.672 . . . . 10.0 111.755 -170.069 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 pttm 174.98 -40.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.777 2.031 . . . . 10.0 115.815 164.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 m -58.39 -30.3 66.71 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.732 1.606 . . . . 10.0 112.04 -178.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.3 mp0 -59.42 -29.08 67.5 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.23 -0.919 . . . . 10.0 112.366 173.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -55.57 13.66 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 119.189 0.904 . . . . 10.0 111.63 -178.476 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -61.06 -34.67 75.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.933 1.293 . . . . 10.0 111.618 175.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -67.33 -45.9 75.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.145 0.884 . . . . 10.0 112.545 174.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.14 -38.36 90.36 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.334 -0.854 . . . . 10.0 113.019 174.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mt -61.16 -51.21 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 118.566 -0.73 . . . . 10.0 109.6 170.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -41.64 85.31 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.876 0.762 . . . . 10.0 112.557 177.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -50.36 -65.73 0.51 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 124.407 1.083 . . . . 10.0 111.557 169.414 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.4 -36.01 82.3 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.491 0.587 . . . . 10.0 112.131 -175.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -65.75 -21.61 66.53 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.423 1.489 . . . . 10.0 114.263 176.029 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -87.79 -52.56 5.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.466 1.03 . . . . 10.0 111.422 160.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -26.05 52.97 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 -170.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.5 t -74.11 -1.86 22.03 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.42 1.488 . . . . 10.0 114.126 172.674 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -154.08 -18.61 0.13 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 117.12 2.267 . . . . 10.0 117.12 -178.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.074 -1.917 . . . . 10.0 114.561 177.952 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.632 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 CA-C-O 118.828 -0.984 . . . . 10.0 111.347 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -140.74 160.12 40.73 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.287 1.588 . . . . 10.0 115.287 -149.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.17 -53.0 54.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 125.817 1.647 . . . . 10.0 112.749 -179.22 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -44.45 97.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.786 1.176 . . . . 10.0 113.335 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -56.13 -36.22 68.0 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.675 0.75 . . . . 10.0 110.793 172.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.37 -51.42 6.7 Favored Glycine 0 C--O 1.224 -0.512 0 C-N-CA 125.248 1.404 . . . . 10.0 110.288 -173.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -37.52 83.38 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.111 1.456 . . . . 10.0 112.637 177.248 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -59.94 -56.79 17.33 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.625 0.77 . . . . 10.0 111.594 174.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -31.76 47.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 118.438 0.563 . . . . 10.0 111.816 -178.45 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -56.41 -51.08 69.69 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.371 -1.455 . . . . 10.0 110.576 168.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.68 -15.53 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 113.682 0.993 . . . . 10.0 113.682 178.375 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -90.09 -43.6 10.38 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.025 1.33 . . . . 10.0 111.78 -179.631 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -119.2 -11.37 9.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.932 1.456 . . . . 10.0 114.932 -169.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -120.32 -44.17 2.49 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.451 1.5 . . . . 10.0 111.434 -172.345 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.31 -11.17 20.03 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.696 0.998 . . . . 10.0 113.696 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.25 -25.95 26.18 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.953 2.101 . . . . 10.0 112.553 164.04 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.8 m -141.68 -19.29 0.75 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 10.0 113.629 -173.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.419 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 92.3 m-70 -130.25 86.16 2.37 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 10.0 110.897 -177.067 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.2 p -69.69 18.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.574 2.064 . . . . 10.0 116.574 -167.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.71 -35.07 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 O-C-N 120.642 -1.286 . . . . 10.0 113.509 -160.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -62.99 -0.84 0.76 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.131 1.772 . . . . 10.0 114.271 177.077 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -150.28 13.68 0.77 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.109 2.164 . . . . 10.0 111.561 178.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.13 -73.18 0.13 Allowed Glycine 0 CA--C 1.532 1.126 0 C-N-CA 125.137 1.351 . . . . 10.0 112.312 -169.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.37 -119.17 8.72 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 126.545 2.022 . . . . 10.0 112.442 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 165.87 22.25 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.728 2.011 . . . . 10.0 110.454 169.306 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -64.9 81.05 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.746 1.219 . . . . 10.0 112.665 178.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -68.86 -31.1 69.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.53 1.532 . . . . 10.0 112.512 179.67 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.8 m -155.07 -23.75 0.12 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.254 -0.879 . . . . 10.0 113.248 172.589 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.419 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -124.98 170.99 16.95 Favored Glycine 0 CA--C 1.54 1.653 0 CA-C-N 119.657 1.117 . . . . 10.0 111.95 167.125 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.24 44.18 1.6 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 124.908 3.739 . . . . 10.0 113.969 -153.197 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 48.14 18.84 0.16 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.172 2.189 . . . . 10.0 115.963 -178.378 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt 33.37 64.6 0.3 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.964 2.905 . . . . 10.0 112.835 -179.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -54.11 80.48 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.83 2.452 . . . . 10.0 111.748 172.098 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.04 -47.89 0.07 OUTLIER Glycine 0 CA--C 1.536 1.358 0 C-N-CA 129.827 3.584 . . . . 10.0 116.237 -179.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.276 8.6 mp 53.78 -148.8 0.44 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.533 1.933 . . . . 10.0 110.295 -165.67 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 34.8 59.52 0.68 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.148 2.179 . . . . 10.0 114.959 178.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 115.81 -27.2 8.43 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.693 2.092 . . . . 10.0 113.17 -174.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -69.49 74.26 0.38 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.071 1.348 . . . . 10.0 111.344 170.087 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt 34.03 -125.25 0.09 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 129.927 3.291 . . . . 10.0 113.776 161.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.7 m -149.52 -79.62 0.13 Allowed 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.163 -1.585 . . . . 10.0 109.742 171.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.59 88.47 0.73 Allowed Glycine 0 CA--C 1.535 1.296 0 O-C-N 120.357 -1.464 . . . . 10.0 115.541 179.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -134.4 9.53 3.72 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.452 1.279 . . . . 10.0 114.452 -178.085 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.8 140.34 93.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 121.031 -1.043 . . . . 10.0 112.266 -176.735 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -77.61 52.34 3.91 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 124.104 3.203 . . . . 10.0 112.876 -177.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.88 -96.49 0.37 Allowed Glycine 0 CA--C 1.527 0.785 0 C-N-CA 126.347 1.927 . . . . 10.0 110.869 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.7 t80 32.8 100.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.758 2.823 . . . . 10.0 117.234 165.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 m -66.33 90.25 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.168 -0.957 . . . . 10.0 112.258 168.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -83.13 174.0 11.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.298 1.439 . . . . 10.0 110.447 161.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.0 p -74.42 30.88 0.08 Allowed 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -174.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.5 t70 45.73 -69.02 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 129.849 3.259 . . . . 10.0 115.593 -166.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.04 -45.73 61.4 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.026 1.73 . . . . 10.0 113.552 -150.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -45.9 -70.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.38 1.472 . . . . 10.0 111.748 171.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.512 ' HZ1' ' CGA' ' A' ' 105' ' ' HEC . 18.9 mtpp -71.19 -25.37 62.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.581 1.552 . . . . 10.0 112.447 -171.197 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.56 -45.93 92.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.51 1.524 . . . . 10.0 112.697 161.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.71 -24.13 65.35 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.27 0.941 . . . . 10.0 113.184 -170.198 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.77 26.9 70.19 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-O 119.1 -0.833 . . . . 10.0 115.072 163.46 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -3.96 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 115.847 1.795 . . . . 10.0 115.847 -171.615 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.4 m 57.86 108.9 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.565 2.346 . . . . 10.0 114.002 -170.551 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.443 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 25.1 m95 -67.24 119.76 12.67 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.284 -0.871 . . . . 10.0 112.349 173.067 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -166.63 -175.92 3.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.742 2.817 . . . . 10.0 108.768 175.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -45.59 -53.08 9.63 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.645 1.578 . . . . 10.0 111.635 176.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.67 15.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.862 2.065 . . . . 10.0 116.047 -174.833 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.9 p -157.73 -39.26 0.07 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.94 -1.1 . . . . 10.0 110.879 -169.221 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -30.19 59.65 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.181 1.355 . . . . 10.0 112.787 174.841 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -51.03 58.46 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 119.613 1.097 . . . . 10.0 108.616 174.743 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.81 -37.74 87.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.506 0.722 . . . . 10.0 110.653 -179.807 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -66.06 -65.38 0.68 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.403 -0.808 . . . . 10.0 112.561 173.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -17.26 64.71 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.818 1.645 . . . . 10.0 114.301 -172.756 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.93 -32.05 71.38 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.806 1.185 . . . . 10.0 113.557 165.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -163.23 79.31 1.67 Allowed Pre-proline 0 CA--C 1.549 0.933 0 CA-C-N 119.754 1.161 . . . . 10.0 111.642 177.262 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 73' ' ' LYS . 37.7 Cg_endo -69.36 -52.25 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.189 1.926 . . . . 10.0 110.873 -163.919 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -67.78 24.88 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.767 2.827 . . . . 10.0 114.568 -177.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' A' ' 71' ' ' PRO . 0.1 OUTLIER -160.91 -28.8 0.06 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.921 2.089 . . . . 10.0 111.894 -175.081 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -64.62 -38.6 91.56 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 119.273 0.942 . . . . 10.0 112.006 165.376 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.4 pt -133.78 151.08 76.34 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 124.239 1.016 . . . . 10.0 111.381 176.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.1 162.2 41.36 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.725 2.284 . . . . 10.0 111.213 173.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 39.7 61.85 1.51 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.955 1.74 . . . . 10.0 114.775 172.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.9 t -121.08 -14.41 8.41 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.101 1.519 . . . . 10.0 115.101 178.198 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? 54.5 -67.14 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 127.668 2.387 . . . . 10.0 116.071 179.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.1 ttt 13.53 85.17 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 130.961 3.704 . . . . 10.0 113.838 -177.15 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -70.53 80.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.856 1.263 . . . . 10.0 109.553 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -162.95 -51.83 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.455 1.502 . . . . 10.0 111.19 172.086 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 35.15 57.6 0.79 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.845 2.458 . . . . 10.0 116.449 170.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 161.41 -166.96 36.11 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.457 1.027 . . . . 10.0 111.594 179.446 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 tt -158.08 178.15 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.826 1.65 . . . . 10.0 109.475 166.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -88.9 166.96 13.61 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.844 1.202 . . . . 10.0 111.047 178.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.468 ' HG3' ' H ' ' A' ' 88' ' ' LYS 0.258 8.6 ptpp? 40.21 -103.53 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.602 1.961 . . . . 10.0 112.153 -172.522 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.468 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 49.2 tttp -163.17 -32.95 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.828 1.251 . . . . 10.0 112.578 154.003 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.9 m -59.06 -21.39 59.09 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 -178.882 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -54.64 -32.77 59.57 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.067 -1.021 . . . . 10.0 112.354 167.444 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.35 -22.36 61.17 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.226 1.411 . . . . 10.0 112.744 175.423 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.26 -53.91 7.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.238 1.015 . . . . 10.0 110.402 164.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.65 1.58 . . . . 10.0 111.735 -169.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 mp -53.69 -42.95 68.52 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 114.499 1.296 . . . . 10.0 114.499 173.668 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.8 mm -66.09 -50.86 66.06 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.238 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.132 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.42 66.28 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.916 -1.04 . . . . 10.0 113.301 179.471 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -66.51 -69.2 0.32 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.67 1.988 . . . . 10.0 112.557 159.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.79 -20.6 63.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.085 0.772 . . . . 10.0 113.085 -173.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.17 -35.52 62.4 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.883 2.073 . . . . 10.0 113.371 166.815 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -81.27 -46.0 15.42 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.037 1.335 . . . . 10.0 110.874 171.399 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.2 -1.02 0.27 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.453 2.39 . . . . 10.0 117.453 -166.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.7 t -133.85 15.42 3.94 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.838 1.255 . . . . 10.0 114.227 168.4 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -151.02 -13.48 0.22 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.767 1.627 . . . . 10.0 114.172 -169.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.949 1.699 . . . . 10.0 114.25 177.214 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.512 ' CGA' ' HZ1' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.942 0 CA-C-O 117.914 -1.492 . . . . 10.0 111.792 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -139.53 164.59 29.48 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.119 1.459 . . . . 10.0 114.823 -173.601 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.4 t -75.29 -61.22 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 126.281 1.832 . . . . 10.0 109.879 165.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -60.0 -47.36 86.14 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.986 -1.071 . . . . 10.0 113.531 -175.236 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -59.16 -31.47 69.01 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 117.871 0.305 . . . . 10.0 111.226 172.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.23 -50.94 19.82 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 125.858 1.694 . . . . 10.0 111.379 178.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -32.7 74.36 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 117.879 0.84 . . . . 10.0 111.813 -179.337 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -63.26 -55.2 26.84 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.802 1.241 . . . . 10.0 111.413 173.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.251 0.2 OUTLIER -68.3 -30.17 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 CA-C-N 118.473 0.579 . . . . 10.0 111.747 -179.474 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -56.35 -54.06 49.93 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 120.468 -1.395 . . . . 10.0 110.83 164.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.2 t -62.23 -13.93 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 O-C-N 121.308 -0.87 . . . . 10.0 113.209 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -91.93 -42.16 10.19 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.641 1.177 . . . . 10.0 112.285 178.508 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -124.44 -3.06 7.93 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.63 1.715 . . . . 10.0 115.63 -168.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.7 m -120.67 -43.9 2.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.909 1.684 . . . . 10.0 111.0 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.64 -4.37 8.62 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.493 1.294 . . . . 10.0 114.493 176.304 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.47 -12.38 60.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.64 1.176 . . . . 10.0 113.964 164.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.63 -40.57 0.29 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.622 1.569 . . . . 10.0 112.49 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.456 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.5 m-70 -93.68 -161.61 0.86 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 127.504 2.322 . . . . 10.0 109.034 166.246 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 m -154.8 -55.07 0.1 Allowed 'General case' 0 N--CA 1.482 1.175 0 O-C-N 119.847 -1.783 . . . . 10.0 112.574 165.281 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t 61.2 -71.75 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.085 1.754 . . . . 10.0 114.422 177.568 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.35 -52.75 64.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.342 1.057 . . . . 10.0 111.769 -166.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -153.17 100.27 2.45 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.953 1.301 . . . . 10.0 110.582 -171.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.79 -7.73 8.25 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 117.003 1.561 . . . . 10.0 117.003 165.505 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.95 7.03 21.05 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.765 1.782 . . . . 10.0 117.33 169.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -75.0 75.36 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.633 2.373 . . . . 10.0 113.706 -164.146 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -64.27 62.17 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 128.551 2.74 . . . . 10.0 113.647 172.848 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.04 -21.0 65.94 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.321 -1.487 . . . . 10.0 113.667 176.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -154.4 -1.03 0.19 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.665 1.121 . . . . 10.0 114.019 174.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.456 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -148.89 156.61 26.92 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-N 120.681 1.582 . . . . 10.0 112.328 167.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.99 3.91 3.6 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 124.79 3.66 . . . . 10.0 117.088 -151.04 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 64.32 149.12 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.482 2.713 . . . . 10.0 112.654 -144.646 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -83.54 50.0 1.7 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.647 1.179 . . . . 10.0 110.691 176.135 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.46 98.45 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 128.267 2.627 . . . . 10.0 113.821 -173.92 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 17.96 68.02 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.562 1.077 . . . . 10.0 114.651 173.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -61.06 172.28 1.05 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 118.914 1.357 . . . . 10.0 112.015 179.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.281 77.5 m-85 71.38 68.25 0.16 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.395 1.878 . . . . 10.0 111.614 -163.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.2 -23.45 5.19 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 126.731 2.11 . . . . 10.0 113.215 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mtp85 -77.68 162.51 26.95 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.401 1.096 . . . . 10.0 112.557 173.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 179.02 4.42 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.459 2.304 . . . . 10.0 111.765 171.74 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.3 p -73.82 174.87 7.86 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.295 1.038 . . . . 10.0 109.439 161.294 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.39 -179.37 37.52 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-O 121.788 0.66 . . . . 10.0 111.717 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 65.32 166.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.563 1.945 . . . . 10.0 114.696 -176.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 162.36 167.38 0.05 OUTLIER Pre-proline 0 CA--C 1.546 0.824 1 C-N-CA 133.216 4.607 . . . . 10.0 105.212 -169.222 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.77 -143.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.55 1.318 0 C-N-CA 122.538 2.159 . . . . 10.0 108.927 146.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.88 18.94 0.17 Allowed Glycine 0 CA--C 1.544 1.862 0 N-CA-C 117.447 1.739 . . . . 10.0 117.447 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -77.35 106.06 8.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.443 1.622 . . . . 10.0 110.893 175.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 m -65.61 138.64 58.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.13 1.372 . . . . 10.0 111.567 173.435 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.449 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.46 -178.94 6.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.519 1.528 . . . . 10.0 112.3 -175.126 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.3 p -71.78 164.35 26.15 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.203 0.601 . . . . 10.0 111.805 167.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -75.48 -111.24 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.236 -0.915 . . . . 10.0 109.847 163.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 35.81 -87.34 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 130.086 3.354 . . . . 10.0 115.051 168.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -45.82 -56.97 4.7 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.209 1.403 . . . . 10.0 112.738 170.428 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.449 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -63.5 -35.78 81.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.227 0.611 . . . . 10.0 111.27 -175.71 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.21 -43.76 85.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.643 2.377 . . . . 10.0 113.417 172.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -21.94 55.09 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.851 1.797 . . . . 10.0 115.851 -167.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.06 -7.54 63.08 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 116.24 1.256 . . . . 10.0 116.24 159.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.6 pp -56.77 141.71 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 118.61 1.205 . . . . 10.0 111.966 -177.081 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.8 m -67.83 117.9 10.34 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 121.641 -0.662 . . . . 10.0 110.013 -178.288 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.447 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 3.7 m95 -71.18 113.55 8.33 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 170.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.62 179.52 7.14 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 10.0 111.887 -168.642 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -69.74 42.91 0.05 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.279 1.831 . . . . 10.0 115.207 -172.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -160.23 -66.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.132 2.173 . . . . 10.0 108.254 -176.372 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.0 p -57.22 -38.24 73.45 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 126.594 1.958 . . . . 10.0 112.731 -179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.57 -23.25 56.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 10.0 113.035 176.772 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -51.91 30.63 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.151 1.341 . . . . 10.0 108.466 169.454 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.2 -43.72 98.43 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 123.431 0.457 . . . . 10.0 110.315 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.61 -57.88 10.83 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 118.304 -0.855 . . . . 10.0 111.931 175.298 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.76 -28.79 67.11 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 120.288 1.404 . . . . 10.0 113.645 -172.114 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -78.88 -19.58 51.58 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.521 1.304 . . . . 10.0 114.521 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.4 60.73 1.43 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.37 1.068 . . . . 10.0 110.856 -167.681 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.95 -58.85 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.519 2.146 . . . . 10.0 111.343 -168.142 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -70.63 38.2 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 129.034 2.934 . . . . 10.0 113.174 179.206 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.07 -49.52 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 128.391 2.676 . . . . 10.0 108.828 -169.391 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -62.18 -36.78 82.92 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.907 0.321 . . . . 10.0 111.539 174.684 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.82 154.59 73.01 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 126.163 1.785 . . . . 10.0 108.72 166.122 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.43 164.81 34.52 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 121.65 1.566 . . . . 10.0 110.425 165.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.32 66.84 2.33 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.184 -0.787 . . . . 10.0 114.208 168.356 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -129.49 -33.26 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.786 1.773 . . . . 10.0 115.786 172.68 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 62.78 -63.26 0.11 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 116.954 -1.498 . . . . 10.0 113.889 -170.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.1 ttt 10.27 91.29 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 129.715 3.206 . . . . 10.0 114.512 -173.098 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 19.9 mm -72.51 74.2 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 125.376 1.47 . . . . 10.0 110.895 -175.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -163.29 -49.46 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.615 1.566 . . . . 10.0 112.101 169.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.83 78.62 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.717 2.407 . . . . 10.0 115.576 172.876 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.62 -159.48 25.86 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.206 1.384 . . . . 10.0 112.916 -176.675 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.9 tt -153.84 -178.66 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.376 1.47 . . . . 10.0 109.812 157.046 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -76.36 -87.2 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.804 1.242 . . . . 10.0 114.003 -166.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -65.74 0.9 Allowed 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.669 1.577 . . . . 10.0 111.342 -176.107 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.6 pttt 174.57 -61.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.905 2.482 . . . . 10.0 111.721 176.574 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.4 m -59.46 -20.72 57.36 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 -173.209 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -56.3 -26.99 54.06 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.081 0.855 . . . . 10.0 112.529 168.485 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -50.07 75.21 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 125.025 1.33 . . . . 10.0 110.898 172.285 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -62.72 -48.36 79.58 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.052 1.341 . . . . 10.0 110.222 176.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -59.88 -48.62 80.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.516 1.126 . . . . 10.0 111.773 -172.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mp -54.99 -49.64 70.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.19 0.811 . . . . 10.0 113.19 173.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.2 mm -62.67 -45.76 98.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 123.264 0.625 . . . . 10.0 109.69 -178.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.88 -46.86 86.84 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.817 1.247 . . . . 10.0 112.236 174.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.12 -59.95 4.19 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.875 0.87 . . . . 10.0 111.273 173.988 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.24 -37.95 89.3 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -173.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -62.06 -24.45 67.1 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.04 0.936 . . . . 10.0 112.852 176.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.51 -59.06 2.49 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.517 1.527 . . . . 10.0 111.896 165.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.61 -32.52 63.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.63 1.572 . . . . 10.0 114.588 -171.361 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -54.61 -32.27 58.52 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 174.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -87.93 -20.3 26.11 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.171 1.388 . . . . 10.0 114.372 177.957 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 116.128 -1.892 . . . . 10.0 112.939 -140.714 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.447 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 110.063 -1.215 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.446 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.7 OUTLIER -134.03 96.17 3.58 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.231 1.413 . . . . 10.0 107.447 -152.579 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.9 p -49.49 -39.02 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.679 1.592 . . . . 10.0 113.853 -162.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 53.4 mp0 -71.13 -32.65 69.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.85 1.26 . . . . 10.0 113.987 178.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.3 mttt -75.68 -28.31 58.61 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 125.252 1.421 . . . . 10.0 111.436 174.53 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.61 -42.42 93.45 Favored Glycine 0 C--N 1.334 0.462 0 N-CA-C 109.951 -1.26 . . . . 10.0 109.951 -173.36 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -62.87 -41.52 99.42 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.85 0.685 . . . . 10.0 112.85 173.099 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -62.21 -54.86 34.84 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.812 1.645 . . . . 10.0 111.323 179.406 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 tp -69.23 -33.4 57.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 122.637 0.375 . . . . 10.0 111.577 -179.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -57.67 -49.7 75.61 Favored 'General case' 0 C--N 1.344 0.356 0 O-C-N 121.663 -0.648 . . . . 10.0 110.672 168.335 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.41 -15.52 10.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.054 -1.029 . . . . 10.0 113.72 178.567 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -92.69 -41.8 9.96 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.291 1.037 . . . . 10.0 112.644 -179.527 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -117.94 -11.12 10.29 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.749 1.389 . . . . 10.0 114.749 -171.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.4 m -122.64 -45.94 2.15 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.404 1.482 . . . . 10.0 111.239 -169.739 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.94 -16.4 42.07 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 175.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -20.62 10.42 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 129.996 3.318 . . . . 10.0 113.699 166.464 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.9 m -142.46 -15.29 0.75 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.763 2.025 . . . . 10.0 113.443 178.413 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -133.43 62.11 1.66 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.691 2.397 . . . . 10.0 109.854 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -64.42 114.93 4.64 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.597 -1.314 . . . . 10.0 109.943 -177.293 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.5 t -140.9 -49.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.675 1.19 . . . . 10.0 111.676 -160.791 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.12 -10.36 1.17 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.021 1.328 . . . . 10.0 113.912 -177.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -150.15 15.56 0.82 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.486 2.714 . . . . 10.0 110.437 -179.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.57 165.35 2.75 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 127.501 2.477 . . . . 10.0 115.232 -174.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 174.2 150.6 7.76 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.262 0.934 . . . . 10.0 113.803 169.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.84 59.86 1.66 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 115.209 1.559 . . . . 10.0 115.209 -171.613 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 m170 64.26 -64.79 0.14 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.79 2.836 . . . . 10.0 114.438 171.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt 61.17 -48.57 0.12 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 129.986 3.314 . . . . 10.0 116.052 178.07 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.77 -7.42 0.23 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.209 1.404 . . . . 10.0 112.613 -170.025 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -152.38 169.46 31.58 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.213 1.387 . . . . 10.0 110.648 171.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -72.29 9.62 1.13 Allowed 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.983 3.122 . . . . 10.0 115.238 -169.468 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 47.14 162.1 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 129.566 3.146 . . . . 10.0 114.39 -149.408 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -80.43 76.08 7.26 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.117 -0.99 . . . . 10.0 108.395 170.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -65.6 -174.01 0.18 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.929 1.292 . . . . 10.0 110.814 166.273 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.22 119.79 2.07 Favored Glycine 0 CA--C 1.537 1.426 0 O-C-N 121.24 -0.913 . . . . 10.0 112.205 166.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.45 -165.34 1.49 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 129.636 3.175 . . . . 10.0 109.137 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.309 76.6 m-85 63.4 -17.38 0.06 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.313 3.045 . . . . 10.0 118.774 173.075 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -138.69 -25.7 0.31 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 127.092 2.282 . . . . 10.0 113.432 163.539 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.4 170.28 12.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.946 1.299 . . . . 10.0 113.159 177.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.18 161.79 17.86 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.962 -1.086 . . . . 10.0 113.395 177.318 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.5 m -77.79 144.09 37.41 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.699 1.6 . . . . 10.0 110.539 179.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.18 0.39 65.69 Favored Glycine 0 N--CA 1.472 1.098 0 N-CA-C 115.652 1.021 . . . . 10.0 115.652 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -71.19 49.28 0.14 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 127.208 2.203 . . . . 10.0 113.81 -179.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.26 137.24 71.91 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 128.169 2.588 . . . . 10.0 113.394 -178.263 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.63 46.55 1.89 Allowed 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 123.505 2.803 . . . . 10.0 112.758 173.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.55 80.39 1.18 Allowed Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.628 1.585 . . . . 10.0 114.732 173.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -153.07 125.69 8.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.539 1.135 . . . . 10.0 111.425 173.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -79.93 87.78 5.34 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.851 1.261 . . . . 10.0 111.897 179.1 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.83 176.86 8.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.48 1.512 . . . . 10.0 112.513 166.25 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.62 131.06 45.91 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.684 1.994 . . . . 10.0 109.898 158.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -75.13 -159.66 0.1 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.128 0.971 . . . . 10.0 111.67 172.329 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.38 -69.49 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.658 1.983 . . . . 10.0 113.524 -169.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.43 ' ND2' ' H ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -51.23 -51.36 54.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.383 1.873 . . . . 10.0 112.747 174.43 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.43 ' H ' ' ND2' ' A' ' 52' ' ' ASN . 1.8 mmpt? -72.1 -42.59 65.92 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.592 1.157 . . . . 10.0 113.107 170.584 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.6 -41.19 69.65 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.812 0.845 . . . . 10.0 112.75 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.85 -11.62 60.43 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.379 1.252 . . . . 10.0 114.379 176.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.97 9.02 55.77 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 118.182 2.033 . . . . 10.0 118.182 151.397 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.8 pp -40.64 10.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.236 2 C-N-CA 135.274 5.43 . . . . 10.0 121.893 -154.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.3 m 57.03 109.67 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 128.361 2.664 . . . . 10.0 114.646 -173.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 31.2 m95 -71.28 134.53 46.87 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.575 -1.193 . . . . 10.0 112.091 166.214 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -164.89 173.59 11.51 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 131.135 3.774 . . . . 10.0 105.595 173.12 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -57.6 -36.0 71.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 120.442 1.474 . . . . 10.0 114.036 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.97 -54.7 34.35 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.994 1.27 . . . . 10.0 111.165 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.8 p -65.77 -38.94 90.42 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.761 0.825 . . . . 10.0 111.928 -179.347 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.13 -27.61 59.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.497 1.044 . . . . 10.0 113.471 175.14 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 19.1 mtm -63.5 -53.45 51.82 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.154 1.343 . . . . 10.0 109.274 170.426 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -59.44 -45.82 90.49 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.916 0.76 . . . . 10.0 109.582 179.138 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -65.36 -48.35 73.27 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.59 -0.719 . . . . 10.0 112.762 -179.163 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.38 -29.45 67.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 120.849 1.659 . . . . 10.0 112.103 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -80.07 -22.82 41.84 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.727 1.38 . . . . 10.0 114.727 174.848 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.99 84.59 1.43 Allowed Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.218 1.407 . . . . 10.0 114.431 169.038 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.27 -49.03 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.364 2.043 . . . . 10.0 113.364 -165.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -71.66 -32.6 68.08 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.618 1.567 . . . . 10.0 111.519 -172.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -71.36 -41.84 69.22 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.603 1.161 . . . . 10.0 111.864 168.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -64.88 -48.92 72.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.18 0.9 . . . . 10.0 113.231 178.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 10.2 pt -128.75 102.39 19.79 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.688 0.795 . . . . 10.0 110.763 173.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.19 136.32 40.16 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.513 2.142 . . . . 10.0 110.752 -177.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.3 -32.39 5.09 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.581 1.562 . . . . 10.0 113.255 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m -50.44 -24.79 3.32 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 118.784 2.883 . . . . 10.0 118.784 -165.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.29 -82.69 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 116.914 -1.517 . . . . 10.0 111.602 -162.174 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.2 ttt 31.25 95.47 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.398 2.679 . . . . 10.0 113.893 -169.026 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.7 mt -71.69 45.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 C-N-CA 126.772 2.029 . . . . 10.0 112.759 -175.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -163.45 86.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.245 2.218 . . . . 10.0 108.847 178.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.23 -13.73 62.3 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.138 1.532 . . . . 10.0 115.138 -170.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.3 165.12 31.52 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.655 1.121 . . . . 10.0 111.84 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.3 tt -95.08 170.36 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.061 1.345 . . . . 10.0 111.968 -178.199 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -45.68 -45.32 14.07 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.616 2.366 . . . . 10.0 114.604 -167.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -164.55 177.87 7.79 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.945 2.498 . . . . 10.0 108.661 168.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -64.36 -27.92 69.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.332 1.605 . . . . 10.0 115.332 -171.26 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.33 -49.95 74.48 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.935 1.698 . . . . 10.0 112.025 -179.824 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -76.66 -6.61 52.78 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.195 1.798 . . . . 10.0 114.569 172.236 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER -78.76 -36.1 43.56 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.634 -1.916 . . . . 10.0 112.502 156.591 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -69.16 -42.69 75.58 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.69 -1.256 . . . . 10.0 111.002 174.661 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.446 ' CB ' ' H ' ' A' ' 2' ' ' ASP 0.256 1.0 OUTLIER -60.68 -38.19 84.13 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.909 0.484 . . . . 10.0 112.217 -179.131 . . . . . . . . 4 4 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 mp -57.09 -47.84 80.05 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.581 1.952 . . . . 10.0 113.325 166.823 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.89 -49.69 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.306 0.957 . . . . 10.0 109.458 173.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.4 -46.48 86.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.129 0.972 . . . . 10.0 112.694 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.74 -61.71 2.39 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.094 1.357 . . . . 10.0 111.696 171.452 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.1 -28.24 69.31 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.355 -0.841 . . . . 10.0 112.897 -171.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.15 -16.31 63.86 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 172.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -107.38 -24.21 11.92 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 167.773 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.37 60.46 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.068 1.136 . . . . 10.0 114.068 -177.718 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.1 p -86.92 -4.74 59.21 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.085 1.354 . . . . 10.0 113.668 175.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -153.45 -7.42 0.17 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 116.264 1.95 . . . . 10.0 116.264 -165.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.972 -1.966 . . . . 10.0 114.088 166.549 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.497 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.581 ' H3 ' ' CG ' ' A' ' 93' ' ' ASP . . . . . . . . 0 N--CA 1.469 0.895 0 CA-C-O 118.861 -0.966 . . . . 10.0 111.333 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.29 155.61 49.9 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -150.031 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 89.5 t -55.93 -52.87 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 125.25 1.42 . . . . 10.0 110.553 177.042 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -53.38 -53.85 45.13 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.036 1.734 . . . . 10.0 113.691 179.172 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -55.57 -36.43 66.83 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.201 0.6 . . . . 10.0 110.828 173.321 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.53 -53.11 8.91 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.414 -1.074 . . . . 10.0 110.414 -172.088 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.9 pttt -57.54 -46.21 84.14 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.533 1.166 . . . . 10.0 112.466 -179.766 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -67.98 -46.23 71.93 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.601 0.76 . . . . 10.0 112.586 -178.682 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.1 mm -65.7 -35.55 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 118.733 0.697 . . . . 10.0 111.252 175.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -61.22 -53.6 54.81 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.99 0.814 . . . . 10.0 111.293 172.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.5 t -62.92 -11.63 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.341 -0.849 . . . . 10.0 112.81 -178.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -93.38 -59.27 2.06 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.76 1.624 . . . . 10.0 110.908 174.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -95.75 -12.35 25.53 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.738 1.385 . . . . 10.0 114.738 -168.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -123.73 -43.68 2.12 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.932 1.293 . . . . 10.0 111.732 -167.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.52 -7.73 5.11 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 167.093 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -16.44 12.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.766 2.027 . . . . 10.0 113.463 163.305 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.1 m -143.34 -27.48 0.56 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.204 1.802 . . . . 10.0 114.053 179.007 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -107.49 -161.68 0.79 Allowed 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 128.916 2.887 . . . . 10.0 111.309 -178.688 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -151.3 -61.79 0.18 Allowed 'General case' 0 N--CA 1.483 1.2 0 O-C-N 119.639 -1.913 . . . . 10.0 113.765 152.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.416 ' HB ' ' H ' ' A' ' 32' ' ' LEU 0.277 5.1 p 51.51 -48.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 130.219 3.408 . . . . 10.0 117.786 -175.477 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.15 128.26 34.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.122 1.328 . . . . 10.0 108.02 168.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.5 pttt 45.71 30.64 0.85 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.561 1.544 . . . . 10.0 113.842 -169.033 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.87 -66.88 1.73 Allowed Glycine 0 CA--C 1.528 0.885 0 C-N-CA 126.871 2.177 . . . . 10.0 112.515 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.8 -112.43 4.98 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.673 1.606 . . . . 10.0 113.703 -179.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -160.85 -173.78 4.09 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.488 1.515 . . . . 10.0 111.429 -160.885 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -151.77 73.96 1.09 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.078 1.751 . . . . 10.0 110.048 -171.205 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -73.28 -35.14 66.1 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m -152.16 -29.91 0.16 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.961 -168.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -118.28 164.53 12.84 Favored Glycine 0 CA--C 1.538 1.517 0 N-CA-C 109.373 -1.491 . . . . 10.0 109.373 157.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -70.42 167.25 25.85 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.879 2.386 . . . . 10.0 111.413 -178.691 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -64.89 136.9 57.37 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.027 -1.471 . . . . 10.0 107.027 158.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.416 ' H ' ' HB ' ' A' ' 20' ' ' VAL . 2.8 mm? -79.04 66.93 4.61 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.199 -0.938 . . . . 10.0 109.274 -178.713 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.54 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -52.36 91.29 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 129.276 3.03 . . . . 10.0 111.592 -168.928 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 65.45 -70.26 0.1 OUTLIER Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.286 1.422 . . . . 10.0 111.907 -164.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 65.75 -176.33 0.18 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 127.125 2.17 . . . . 10.0 110.411 -168.574 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 55.83 83.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.476 1.51 . . . . 10.0 113.758 179.277 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.3 -7.05 23.01 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.023 2.725 . . . . 10.0 113.638 -177.436 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.54 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 15.8 ttp180 -86.94 -139.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.099 2.16 . . . . 10.0 114.154 -171.719 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -153.39 162.96 40.75 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.995 2.518 . . . . 10.0 111.073 -177.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 55.0 p -67.21 -59.89 3.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.739 1.216 . . . . 10.0 111.38 178.135 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.04 75.11 0.48 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 125.879 1.704 . . . . 10.0 113.835 -178.427 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -0.34 3.88 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.573 1.694 . . . . 10.0 115.573 175.002 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -52.52 134.45 44.12 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.19 1.396 . . . . 10.0 113.356 -176.689 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -82.45 -107.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.749 2.966 . . . . 10.0 111.053 179.549 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.05 48.38 3.02 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.341 -1.474 . . . . 10.0 112.993 178.508 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -151.7 163.56 38.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.375 1.559 . . . . 10.0 111.997 -177.113 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -154.84 111.37 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.664 1.585 . . . . 10.0 107.03 166.773 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -82.17 -43.22 17.99 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.457 1.503 . . . . 10.0 110.658 -176.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.2 p -156.99 -153.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 129.473 3.109 . . . . 10.0 107.773 177.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -159.86 -171.01 3.08 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.901 1.68 . . . . 10.0 108.226 157.618 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 64.55 -32.14 0.13 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.188 2.195 . . . . 10.0 113.759 -157.772 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -75.37 -42.69 53.4 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 121.975 2.17 . . . . 10.0 113.694 166.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -50.89 -51.22 53.94 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.114 -0.991 . . . . 10.0 111.383 172.294 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -66.13 -16.25 63.8 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.555 1.687 . . . . 10.0 115.555 172.03 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.46 -17.21 59.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.28 1.4 . . . . 10.0 114.224 -179.848 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.82 -44.38 2.05 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.336 -1.813 . . . . 10.0 116.6 170.781 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -31.96 3.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.736 2 C-N-CA 133.915 4.886 . . . . 10.0 122.766 -135.232 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 38.3 m 56.21 104.13 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 128.024 2.53 . . . . 10.0 114.889 -177.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -58.31 140.87 52.61 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 113.559 -1.655 . . . . 10.0 110.94 159.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -175.42 -43.29 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.297 1.439 . . . . 10.0 113.763 -165.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.516 ' CD ' ' HZ1' ' A' ' 99' ' ' LYS 0.253 13.6 pt-20 163.29 -62.36 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 130.0 3.32 . . . . 10.0 111.715 165.558 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -46.22 -45.21 16.82 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.39 1.476 . . . . 10.0 112.538 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.8 p -68.63 -31.43 70.58 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 125.02 1.328 . . . . 10.0 112.535 178.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -75.43 -33.25 60.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.114 1.324 . . . . 10.0 112.591 168.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.7 mtm -57.31 -53.45 58.02 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.48 1.112 . . . . 10.0 109.235 175.26 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -67.74 -41.4 83.46 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 123.917 0.761 . . . . 10.0 110.622 178.608 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.66 -53.7 25.66 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.787 0.662 . . . . 10.0 112.787 -175.867 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -60.27 -42.79 96.14 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.957 1.253 . . . . 10.0 110.934 179.041 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -72.06 -23.84 61.43 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 114.599 1.333 . . . . 10.0 114.599 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 61.65 1.59 Allowed Pre-proline 0 CA--C 1.564 1.491 0 C-N-CA 125.007 1.323 . . . . 10.0 111.088 -167.294 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.63 -62.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.359 2.706 . . . . 10.0 113.835 -162.106 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -61.58 -26.49 68.0 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.177 1.391 . . . . 10.0 113.613 -178.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -71.81 -51.53 22.07 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.015 0.926 . . . . 10.0 110.22 170.854 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -60.76 -47.75 84.9 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.447 0.536 . . . . 10.0 112.447 -177.58 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.85 108.09 9.05 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.319 1.047 . . . . 10.0 109.7 174.947 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.55 153.46 60.28 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 122.03 1.82 . . . . 10.0 110.616 172.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.74 46.43 4.56 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-O 118.956 -0.913 . . . . 10.0 111.922 -170.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -138.44 -39.03 0.53 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 116.051 1.871 . . . . 10.0 116.051 -165.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt 60.27 -65.74 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 -171.279 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.7 ttt 20.46 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 130.059 3.344 . . . . 10.0 113.063 -171.193 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 81' ' ' ILE . 4.0 mp -69.5 74.25 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 126.423 1.889 . . . . 10.0 110.054 -175.432 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -163.51 -40.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.8 1.64 . . . . 10.0 112.605 178.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.57 82.6 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.025 2.53 . . . . 10.0 115.253 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.63 -161.37 16.88 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.942 1.258 . . . . 10.0 111.445 -169.217 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.6 tt -143.33 30.37 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.637 1.175 . . . . 10.0 110.435 170.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttt 69.35 0.59 2.94 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.459 2.304 . . . . 10.0 113.993 -175.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -162.61 173.49 13.86 Favored 'General case' 0 CA--C 1.542 0.649 1 C-N-CA 132.551 4.341 . . . . 10.0 106.979 -176.771 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -77.47 -52.06 9.72 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 155.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 m -43.65 -50.62 7.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.377 1.871 . . . . 10.0 113.054 -155.259 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -65.52 -24.47 67.13 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.652 0.781 . . . . 10.0 112.269 -173.347 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.373 0.0 OUTLIER -76.18 -13.0 60.19 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.328 0.967 . . . . 10.0 113.441 172.498 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -67.31 -52.64 37.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.857 0.863 . . . . 10.0 109.979 161.179 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.581 ' CG ' ' H3 ' ' A' ' 1' ' ' GLY . 4.3 m-20 -57.61 -44.28 85.34 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.52 1.528 . . . . 10.0 112.828 177.752 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.88 90.13 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.991 0.737 . . . . 10.0 112.991 174.303 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.3 mt -62.18 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 119.035 -0.507 . . . . 10.0 110.538 173.583 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.31 75.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.43 0.692 . . . . 10.0 111.916 175.307 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.2 -57.51 12.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.813 1.645 . . . . 10.0 112.946 173.062 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -66.72 -29.12 69.03 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.657 1.117 . . . . 10.0 113.22 -175.019 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.516 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 38.4 ttmt -59.27 -26.95 65.37 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.841 0.856 . . . . 10.0 112.919 168.989 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -85.56 -53.23 5.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 117.821 -1.085 . . . . 10.0 112.009 165.644 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.37 -15.74 39.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.967 1.84 . . . . 10.0 115.967 -171.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.3 t -68.46 -2.78 9.42 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.133 1.161 . . . . 10.0 114.133 165.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -151.2 -23.6 0.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.225 1.81 . . . . 10.0 114.071 -176.218 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.7 2.0 . . . . 10.0 110.921 179.639 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.469 ' CGA' HH22 ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 CA-C-O 118.735 -1.036 . . . . 10.0 110.708 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -133.76 161.38 34.86 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.256 1.206 . . . . 10.0 114.256 -152.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.7 m -68.35 -41.49 83.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 122.709 0.403 . . . . 10.0 111.977 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 mp0 -60.76 -49.26 78.22 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.843 1.257 . . . . 10.0 110.26 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.442 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 8.8 mmpt? -62.71 -14.77 47.99 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.687 1.195 . . . . 10.0 113.095 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -104.79 -45.34 1.41 Allowed Glycine 0 C--N 1.339 0.704 0 CA-C-N 119.703 1.138 . . . . 10.0 112.46 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -34.69 72.3 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.709 1.754 . . . . 10.0 112.443 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -62.19 -28.67 69.83 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.832 1.253 . . . . 10.0 114.259 177.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -98.42 -32.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.139 0.976 . . . . 10.0 110.684 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.478 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 t80 -57.82 -54.32 48.25 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 121.823 -0.548 . . . . 10.0 110.935 169.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.5 t -66.01 -11.62 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -90.25 -56.04 3.37 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.721 1.208 . . . . 10.0 111.325 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -125.59 7.76 7.6 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 116.238 1.94 . . . . 10.0 116.238 -168.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 33.7 m -110.76 -49.01 3.07 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.295 1.038 . . . . 10.0 110.648 166.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.53 53.07 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.919 1.081 . . . . 10.0 113.919 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -13.77 39.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.827 2.451 . . . . 10.0 113.564 169.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.6 m -141.15 -33.64 0.52 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.229 1.812 . . . . 10.0 112.237 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -120.19 66.6 0.83 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 128.954 2.902 . . . . 10.0 109.922 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -68.19 127.49 33.11 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.356 -1.465 . . . . 10.0 108.178 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.42 -66.39 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 124.632 1.173 . . . . 10.0 110.595 -176.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.53 -31.32 65.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.184 0.902 . . . . 10.0 112.698 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.17 -6.23 59.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.55 1.14 . . . . 10.0 113.785 178.855 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.177 0 C-N-CA 126.596 2.046 . . . . 10.0 110.871 -163.459 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 N--CA 1.483 1.196 0 N-CA-C 113.398 0.888 . . . . 10.0 113.398 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.66 167.35 24.83 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 157.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.02 127.9 16.8 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.854 2.369 . . . . 10.0 110.805 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.99 127.61 32.19 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.224 -0.923 . . . . 10.0 110.45 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.7 81.5 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.858 1.263 . . . . 10.0 111.862 -170.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.68 73.14 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.111 2.164 . . . . 10.0 109.962 163.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.78 -63.08 0.32 Allowed Glycine 0 CA--C 1.535 1.312 0 C-N-CA 127.718 2.58 . . . . 10.0 114.065 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 68.29 -48.6 0.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.449 2.7 . . . . 10.0 116.022 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.715 ' HB2' HG21 ' A' ' 102' ' ' THR . 41.8 m-85 -63.67 113.44 3.36 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.595 1.089 . . . . 10.0 111.095 -174.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.48 0.0 82.37 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.954 1.264 . . . . 10.0 113.947 -175.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.8 mtp85 -86.89 -127.93 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.901 1.281 . . . . 10.0 110.802 172.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -154.35 173.41 16.23 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.188 1.795 . . . . 10.0 110.99 -172.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 t -95.8 -48.16 5.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.967 0.907 . . . . 10.0 113.344 -174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.05 61.66 2.99 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.528 1.537 . . . . 10.0 111.609 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -130.15 -18.96 3.23 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.088 1.755 . . . . 10.0 113.347 -161.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.32 151.74 86.5 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 124.464 1.105 . . . . 10.0 112.572 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -76.01 -160.19 0.11 Allowed 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 124.277 3.318 . . . . 10.0 110.839 167.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.23 86.96 0.01 OUTLIER Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.715 2.103 . . . . 10.0 115.327 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -144.05 -179.43 6.49 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.329 2.252 . . . . 10.0 109.559 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.6 m -156.86 142.9 17.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 119.741 -1.849 . . . . 10.0 109.774 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.55 -85.72 0.06 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.886 0.874 . . . . 10.0 112.806 -163.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 t -144.93 173.85 11.52 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.639 2.776 . . . . 10.0 108.751 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.05 -37.33 58.42 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.953 -1.092 . . . . 10.0 112.322 155.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.1 -61.82 1.99 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.022 1.329 . . . . 10.0 112.776 -160.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -51.71 -61.82 2.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.963 0.905 . . . . 10.0 111.906 -171.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -56.08 26.79 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.418 1.087 . . . . 10.0 111.847 -176.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -44.2 82.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.176 -0.916 . . . . 10.0 111.737 -171.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.59 -45.25 38.7 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.171 -0.919 . . . . 10.0 111.708 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 55.37 -179.24 0.33 Allowed Glycine 0 CA--C 1.54 1.621 0 N-CA-C 116.696 1.438 . . . . 10.0 116.696 -176.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.66 -6.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 128.328 2.651 . . . . 10.0 113.701 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.0 m 55.84 115.95 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.846 2.059 . . . . 10.0 113.038 -159.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -73.09 126.3 29.67 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.295 -0.878 . . . . 10.0 111.658 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -165.34 176.03 8.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.272 2.229 . . . . 10.0 110.184 -174.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.32 -30.06 64.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.248 1.419 . . . . 10.0 114.33 -176.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -71.96 -71.65 0.27 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.853 0.861 . . . . 10.0 110.746 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.5 p -59.61 -38.15 80.49 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 125.88 1.672 . . . . 10.0 112.844 -165.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.28 -29.44 60.11 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.289 0.949 . . . . 10.0 113.134 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 ttm -69.6 -48.75 59.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 171.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -57.29 -45.0 84.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.275 1.43 . . . . 10.0 110.546 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.415 ' HE1' HG21 ' A' ' 78' ' ' THR . 73.1 t80 -61.48 -60.04 4.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.619 1.568 . . . . 10.0 112.945 172.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -56.63 -32.23 65.12 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.783 1.629 . . . . 10.0 114.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.21 -24.61 63.13 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.909 1.448 . . . . 10.0 114.909 174.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -163.3 91.71 1.17 Allowed Pre-proline 0 CA--C 1.552 1.035 0 CA-C-N 119.759 1.163 . . . . 10.0 112.602 162.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.98 -37.99 2.48 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.406 2.071 . . . . 10.0 112.544 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -59.06 -43.12 91.69 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.878 1.671 . . . . 10.0 112.444 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -75.0 -41.06 60.24 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 118.982 -0.532 . . . . 10.0 111.434 175.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -69.04 -36.72 78.03 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.821 1.415 . . . . 10.0 114.821 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -131.18 127.82 21.99 Favored Pre-proline 0 N--CA 1.475 0.788 0 CA-C-N 119.169 0.895 . . . . 10.0 111.035 172.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.15 93.8 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.912 3.075 . . . . 10.0 113.315 -153.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 110.97 0.0 28.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.574 1.083 . . . . 10.0 114.299 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.415 HG21 ' HE1' ' A' ' 67' ' ' TYR . 12.5 m -60.15 106.58 0.53 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.68 1.24 . . . . 10.0 111.206 172.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -64.36 -56.67 12.8 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.211 -0.9 . . . . 10.0 112.157 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.0 ttt 25.31 84.2 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.814 2.445 . . . . 10.0 114.115 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 30.8 mt -73.57 77.33 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.937 1.295 . . . . 10.0 110.829 -172.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -163.34 -45.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.15 1.78 . . . . 10.0 111.62 170.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.58 0.96 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 120.743 3.608 . . . . 10.0 120.743 172.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.72 170.71 40.65 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 125.516 1.531 . . . . 10.0 111.176 169.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -143.18 63.12 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 118.809 1.305 . . . . 10.0 112.861 -164.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 62.29 -56.87 0.14 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 128.22 2.608 . . . . 10.0 116.096 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -163.47 156.25 18.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.6 2.36 . . . . 10.0 109.096 -169.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -7.7 11.79 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 10.0 115.301 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -54.1 8.8 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.446 1.499 . . . . 10.0 110.751 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -54.28 -35.3 62.42 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.306 1.042 . . . . 10.0 110.95 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -56.8 -65.19 0.66 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.583 1.953 . . . . 10.0 112.107 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -31.56 72.47 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.997 0.74 . . . . 10.0 112.997 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -57.55 -47.42 82.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.692 0.797 . . . . 10.0 110.61 170.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.82 -46.43 84.7 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 175.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.1 mm -56.48 -52.53 51.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.82 60.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 117.64 -1.171 . . . . 10.0 113.669 -174.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.4 -64.87 0.76 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.374 1.869 . . . . 10.0 110.805 162.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.6 mt -60.17 -30.28 69.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.278 0.631 . . . . 10.0 112.684 -174.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -59.3 -21.93 60.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.872 1.064 . . . . 10.0 113.872 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -79.27 -45.19 20.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.694 -1.146 . . . . 10.0 110.809 168.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.19 1.28 0.19 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.304 1.594 . . . . 10.0 115.304 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.715 HG21 ' HB2' ' A' ' 36' ' ' PHE . 9.6 p -110.37 11.84 23.21 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.859 1.663 . . . . 10.0 114.348 168.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -153.57 -34.59 0.11 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.534 1.061 . . . . 10.0 113.815 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 . . . . . 0 C--O 1.259 1.563 0 C-N-CA 125.161 1.385 . . . . 10.0 110.9 149.669 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.896 0 CA-C-O 118.416 -1.213 . . . . 10.0 111.007 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -109.21 145.51 35.74 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.905 0.852 . . . . 10.0 112.467 -167.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.12 -41.43 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 118.413 -0.803 . . . . 10.0 112.005 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -51.79 -57.03 10.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.911 1.284 . . . . 10.0 112.611 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -57.06 -25.5 58.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.006 1.323 . . . . 10.0 111.722 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -86.94 -50.37 3.73 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.406 1.479 . . . . 10.0 111.841 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.5 pttp -63.13 -43.21 99.01 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.76 1.28 . . . . 10.0 111.57 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -40.83 97.7 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.054 -0.974 . . . . 10.0 111.728 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.85 -25.29 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 119.384 0.993 . . . . 10.0 112.774 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -55.96 -50.75 69.94 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.249 -0.907 . . . . 10.0 109.681 163.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.04 29.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 N-CA-C 113.415 0.894 . . . . 10.0 113.415 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -36.57 5.36 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 119.265 -2.147 . . . . 10.0 112.272 164.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.99 -55.59 1.37 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.631 0.772 . . . . 10.0 112.921 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -52.15 -49.49 63.66 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 125.256 1.422 . . . . 10.0 112.802 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.7 -22.87 62.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.925 1.083 . . . . 10.0 113.925 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -16.16 51.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.92 0.888 . . . . 10.0 112.356 173.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 82.1 m -141.34 0.51 1.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.864 1.266 . . . . 10.0 114.228 -174.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 97.1 m-70 -150.47 12.17 0.71 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.593 1.331 . . . . 10.0 114.593 -172.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 t -42.76 104.9 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.7 1.741 . . . . 10.0 115.7 -165.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.8 p -142.29 -8.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 127.339 2.256 . . . . 10.0 112.559 -171.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.73 -18.82 13.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.124 1.369 . . . . 10.0 112.033 165.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -152.76 145.98 24.72 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.395 1.478 . . . . 10.0 110.981 155.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.446 0 C-N-CA 125.354 1.454 . . . . 10.0 115.559 176.8 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 116.676 2.102 . . . . 10.0 116.676 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.57 168.86 14.98 Favored Glycine 0 CA--C 1.543 1.807 0 CA-C-N 120.582 1.537 . . . . 10.0 112.918 171.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 20.9 Cg_endo -71.55 -8.09 22.54 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 124.691 3.594 . . . . 10.0 118.61 -167.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.57 142.16 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.741 1.616 . . . . 10.0 113.87 -154.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -85.51 70.39 10.76 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.052 -1.03 . . . . 10.0 110.157 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.27 114.53 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.316 1.446 . . . . 10.0 110.17 165.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 9.14 76.36 0.01 OUTLIER Glycine 0 N--CA 1.476 1.308 0 C-N-CA 129.044 3.212 . . . . 10.0 115.9 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -30.6 65.3 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 116.189 1.922 . . . . 10.0 116.189 -156.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -85.87 93.67 8.97 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.965 0.802 . . . . 10.0 111.607 -159.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.08 -13.91 6.31 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 127.051 2.262 . . . . 10.0 114.282 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -85.81 157.98 20.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.733 1.266 . . . . 10.0 113.416 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -77.01 169.76 17.75 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.659 1.184 . . . . 10.0 112.023 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.2 t -50.91 155.54 1.17 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.065 2.146 . . . . 10.0 115.927 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 59.11 31.06 68.11 Favored Glycine 0 CA--C 1.539 1.546 0 N-CA-C 118.458 2.143 . . . . 10.0 118.458 155.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -83.59 7.0 18.62 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 120.241 2.021 . . . . 10.0 115.363 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 133.91 93.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.623 1.102 . . . . 10.0 112.72 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.12 87.38 0.73 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.646 2.23 . . . . 10.0 113.041 -172.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.13 -1.7 88.5 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.947 1.736 . . . . 10.0 115.823 167.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -66.39 137.08 56.62 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.754 1.277 . . . . 10.0 112.067 176.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 m -72.61 83.08 1.13 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.716 1.607 . . . . 10.0 112.652 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.28 175.33 9.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.639 1.176 . . . . 10.0 112.917 168.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.1 p -76.68 -175.36 3.36 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.695 1.598 . . . . 10.0 113.572 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -66.79 177.09 1.75 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.208 1.403 . . . . 10.0 113.23 152.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.67 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 129.352 3.061 . . . . 10.0 116.029 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -47.61 -59.93 2.91 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.891 1.678 . . . . 10.0 112.286 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -27.0 68.97 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.545 -0.722 . . . . 10.0 112.482 -176.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -26.8 63.86 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 117.209 2.3 . . . . 10.0 117.209 171.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -163.29 -1.31 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 116.648 2.092 . . . . 10.0 116.648 -155.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -67.85 163.34 47.47 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.63 1.586 . . . . 10.0 114.107 -177.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -66.31 173.89 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.89 2.476 . . . . 10.0 114.206 -176.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 m -69.57 124.33 23.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.024 0.93 . . . . 10.0 110.232 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -75.38 124.64 27.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.578 0.751 . . . . 10.0 111.716 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.8 pttt -171.3 -176.73 1.95 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.562 2.345 . . . . 10.0 109.5 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.33 -55.07 5.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.901 0.88 . . . . 10.0 112.299 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.21 12.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.948 2.499 . . . . 10.0 115.783 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 63.5 p -157.67 -34.8 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.246 1.018 . . . . 10.0 111.356 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -33.27 60.69 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.807 1.185 . . . . 10.0 112.761 169.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 70.3 mtm -66.28 -48.15 71.35 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.979 1.263 . . . . 10.0 110.521 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -63.89 -37.79 88.71 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 122.652 0.381 . . . . 10.0 110.397 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -65.01 -60.63 2.83 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-O 119.035 -0.507 . . . . 10.0 111.927 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -29.92 70.31 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 120.196 1.362 . . . . 10.0 112.444 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -69.08 -31.24 69.84 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 170.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.84 76.79 1.67 Allowed Pre-proline 0 CA--C 1.553 1.078 0 CA-C-N 120.035 1.289 . . . . 10.0 113.163 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.01 -44.23 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.928 1.752 . . . . 10.0 111.942 -159.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -68.03 -30.65 69.93 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 126.427 1.891 . . . . 10.0 112.7 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -76.26 -40.24 52.36 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.737 1.215 . . . . 10.0 112.352 168.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -63.97 -45.88 87.1 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.748 0.704 . . . . 10.0 112.45 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.99 129.39 10.52 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.796 1.638 . . . . 10.0 110.414 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.62 179.42 4.7 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.806 2.337 . . . . 10.0 112.656 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.2 -33.87 1.1 Allowed Glycine 0 CA--C 1.529 0.943 0 C-N-CA 126.216 1.865 . . . . 10.0 114.156 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 90.3 m -60.56 83.26 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.997 1.719 . . . . 10.0 113.957 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.22 31.96 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.477 2.711 . . . . 10.0 114.123 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.7 ttt -64.39 108.78 1.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.058 1.743 . . . . 10.0 111.219 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 mt -76.5 67.33 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.856 1.262 . . . . 10.0 110.481 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -163.43 -35.9 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.693 1.368 . . . . 10.0 114.693 172.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.22 -3.96 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 121.154 3.761 . . . . 10.0 121.154 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.83 -147.72 5.08 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-N 120.868 1.667 . . . . 10.0 112.148 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tt -144.48 171.86 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.937 0.895 . . . . 10.0 108.89 158.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -75.01 -7.31 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.618 1.34 . . . . 10.0 114.618 -160.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.59 -67.37 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.882 1.273 . . . . 10.0 110.666 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.38 -53.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 127.577 2.351 . . . . 10.0 112.634 162.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.7 m -50.92 -33.62 25.07 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.357 1.863 . . . . 10.0 112.118 -168.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -45.15 -50.09 11.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.254 1.422 . . . . 10.0 112.202 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.353 0.0 OUTLIER -77.76 -10.84 59.75 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.112 1.523 . . . . 10.0 115.112 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -75.02 -40.72 60.36 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.163 0.892 . . . . 10.0 110.488 162.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.22 -40.28 78.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.417 1.087 . . . . 10.0 112.092 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 15.9 tp -57.84 -46.23 85.08 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.579 1.552 . . . . 10.0 113.122 178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 mm -59.07 -46.42 91.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 C-N-CA 124.176 0.99 . . . . 10.0 109.786 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -43.36 98.75 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.146 0.43 . . . . 10.0 111.931 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.6 -56.64 19.6 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.824 0.85 . . . . 10.0 111.974 170.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.15 -26.55 68.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.778 1.172 . . . . 10.0 112.955 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.01 -12.2 7.54 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.402 1.481 . . . . 10.0 113.382 167.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -131.62 36.04 3.77 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.206 3.002 . . . . 10.0 111.979 166.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.72 30.69 4.34 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.4 1.48 . . . . 10.0 110.052 154.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -142.36 7.73 1.76 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.895 2.078 . . . . 10.0 115.112 -174.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -153.05 -73.24 0.14 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.454 2.302 . . . . 10.0 108.242 177.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.258 1.529 0 CA-C-O 117.133 -1.413 . . . . 10.0 109.083 124.222 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.96 0 CA-C-O 119.112 -0.826 . . . . 10.0 111.407 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.401 ' HB3' ' H ' ' A' ' 4' ' ' GLU . 57.8 m-20 -93.99 -173.16 3.04 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.399 1.88 . . . . 10.0 110.853 176.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.0 t -78.78 -32.9 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 120.312 -1.492 . . . . 10.0 111.166 143.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.401 ' H ' ' HB3' ' A' ' 2' ' ' ASP . 0.6 OUTLIER -68.15 -36.08 79.1 Favored 'General case' 0 CA--C 1.514 -0.425 0 C-N-CA 128.063 2.545 . . . . 10.0 114.224 -159.653 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -73.36 -25.47 60.61 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.44 -54.5 5.51 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 126.167 1.842 . . . . 10.0 110.289 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -23.39 67.4 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.485 1.291 . . . . 10.0 114.485 178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -76.49 -53.49 8.03 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 120.143 1.338 . . . . 10.0 113.414 164.283 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.32 -31.33 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.438 1.017 . . . . 10.0 112.555 -170.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.56 -51.31 69.06 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.175 0.443 . . . . 10.0 109.999 172.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.2 -9.1 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 112.868 0.692 . . . . 10.0 112.868 -177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -96.11 -47.68 5.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.374 1.47 . . . . 10.0 111.562 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -119.62 -8.53 9.94 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.428 1.64 . . . . 10.0 115.428 -170.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 34.5 m -113.92 -45.16 3.1 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.813 1.245 . . . . 10.0 111.325 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.21 -25.04 61.13 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 176.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.05 -14.39 0.41 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.415 2.686 . . . . 10.0 114.096 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -141.23 -34.7 0.48 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.609 1.564 . . . . 10.0 112.053 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -103.58 -9.68 19.05 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.949 1.463 . . . . 10.0 114.949 -173.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' H ' ' A' ' 20' ' ' VAL 0.359 6.8 t 38.58 -88.93 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.305 2.642 . . . . 10.0 115.694 -166.772 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 19' ' ' THR 0.3 8.7 p 37.48 48.51 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 128.965 2.906 . . . . 10.0 115.986 174.13 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.44 -41.11 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.274 1.03 . . . . 10.0 112.784 170.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -154.14 -40.99 0.09 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 130.431 3.492 . . . . 10.0 110.786 -173.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.128 0 C-N-CA 127.064 2.269 . . . . 10.0 112.302 177.935 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.9 m . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -133.72 163.82 24.42 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.564 2.031 . . . . 10.0 111.754 162.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.72 161.56 21.6 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.261 2.641 . . . . 10.0 112.075 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.546 HD21 ' CD2' ' A' ' 33' ' ' HIS . 8.9 p-10 -65.29 11.25 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 130.267 3.427 . . . . 10.0 115.944 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt 50.52 -33.25 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.952 1 C-N-CA 132.075 4.15 . . . . 10.0 118.181 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.546 ' CD2' HD21 ' A' ' 31' ' ' ASN 0.276 0.0 OUTLIER 34.5 72.58 0.09 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.631 3.172 . . . . 10.0 114.227 178.789 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.92 -34.49 0.74 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 126.288 1.899 . . . . 10.0 114.667 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tp 60.51 -68.08 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.814 3.246 . . . . 10.0 116.387 170.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -65.67 114.51 5.03 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.645 1.578 . . . . 10.0 110.82 -171.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.68 1.83 88.94 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 118.654 -1.081 . . . . 10.0 114.484 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.573 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.6 OUTLIER -78.81 -96.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.887 1.343 . . . . 10.0 108.469 169.557 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -156.64 175.18 14.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.752 2.421 . . . . 10.0 109.781 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.7 m -109.09 95.37 5.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.871 -1.9 . . . . 10.0 105.871 153.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.27 -66.3 0.09 OUTLIER Glycine 0 CA--C 1.528 0.858 0 CA-C-O 122.022 0.79 . . . . 10.0 113.069 -163.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -64.77 133.91 53.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.679 1.992 . . . . 10.0 113.514 -172.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.66 150.76 10.48 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 128.47 2.708 . . . . 10.0 107.317 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.57 66.27 8.55 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.734 2.956 . . . . 10.0 111.817 -176.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.86 71.59 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.295 0.95 . . . . 10.0 115.219 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.11 119.59 10.46 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.08 1.352 . . . . 10.0 111.204 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.0 m -70.92 82.98 0.66 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.291 1.837 . . . . 10.0 113.174 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -86.17 -173.25 4.47 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.795 1.638 . . . . 10.0 113.896 170.071 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.3 t -62.57 172.49 1.57 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 126.188 1.795 . . . . 10.0 111.581 168.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -75.47 -80.44 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 120.417 -1.427 . . . . 10.0 111.511 154.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 69.42 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 131.365 3.866 . . . . 10.0 116.498 -165.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -161.68 -70.89 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.363 2.265 . . . . 10.0 107.601 169.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.544 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -55.16 -37.44 66.99 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.11 2.564 . . . . 10.0 111.197 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.74 -37.6 84.82 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.54 1.136 . . . . 10.0 113.192 176.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -76.91 -50.09 14.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.076 0.853 . . . . 10.0 112.011 170.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.34 82.16 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.896 1.236 . . . . 10.0 113.394 -175.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.5 pp -66.23 -16.95 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.067 -1.255 . . . . 10.0 113.618 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.507 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 24.3 m 55.77 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 129.378 3.071 . . . . 10.0 113.393 -169.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.2 m95 -77.18 146.78 36.84 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 120.887 -1.133 . . . . 10.0 111.421 168.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 58' ' ' THR . 7.2 ptpt -163.64 -51.46 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.351 1.46 . . . . 10.0 110.939 -170.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 171.87 -55.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 130.338 3.455 . . . . 10.0 109.44 164.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -44.72 -54.9 5.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.148 2.179 . . . . 10.0 112.48 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 66.9 p -65.52 -28.25 69.04 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 125.213 1.405 . . . . 10.0 113.209 -173.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.507 HD22 HH12 ' A' ' 91' ' ' ARG . 0.3 OUTLIER -75.21 -28.5 59.99 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.375 1.07 . . . . 10.0 112.337 173.423 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.4 mtm -69.88 -47.5 62.37 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-O 118.738 -0.649 . . . . 10.0 110.793 172.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -61.83 -43.2 99.33 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.153 0.502 . . . . 10.0 110.438 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.482 ' HE1' HG21 ' A' ' 78' ' ' THR . 43.0 t80 -57.97 -67.41 0.34 Allowed 'General case' 0 C--O 1.221 -0.441 0 CA-C-O 117.553 -1.213 . . . . 10.0 111.924 176.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.483 ' HB2' HH11 ' A' ' 91' ' ' ARG . 5.4 mt -65.87 -19.55 65.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 121.439 1.927 . . . . 10.0 114.816 -173.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -73.75 -24.7 59.91 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.813 1.188 . . . . 10.0 113.881 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.78 64.84 1.55 Allowed Pre-proline 0 CA--C 1.559 1.311 0 CA-C-N 120.124 1.329 . . . . 10.0 112.999 -177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -72.32 -46.58 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.183 1.922 . . . . 10.0 113.014 -159.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -26.47 68.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.552 1.141 . . . . 10.0 112.697 176.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -76.16 -48.07 21.87 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.728 0.811 . . . . 10.0 111.291 169.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.65 -38.1 88.38 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.561 0.948 . . . . 10.0 113.561 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 pt -142.81 105.58 5.33 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.819 1.248 . . . . 10.0 109.644 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.16 -24.58 44.29 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.484 2.789 . . . . 10.0 115.321 -155.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.33 -9.53 81.7 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.586 -1.119 . . . . 10.0 114.385 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.482 HG21 ' HE1' ' A' ' 67' ' ' TYR . 86.1 m -76.88 75.75 3.48 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.916 1.858 . . . . 10.0 112.442 -172.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -68.97 27.11 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.714 2.006 . . . . 10.0 114.609 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.8 ttp -50.67 117.68 2.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.31 2.244 . . . . 10.0 111.83 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.0 mt -76.48 68.3 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.511 1.524 . . . . 10.0 109.638 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -163.85 -32.28 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.466 1.506 . . . . 10.0 113.533 174.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.7 -24.06 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 120.145 3.387 . . . . 10.0 120.145 -173.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 173.02 167.2 32.6 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 122.131 2.242 . . . . 10.0 113.844 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 tt -93.32 160.71 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.868 0.867 . . . . 10.0 111.909 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.07 -31.49 65.26 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 116.024 1.861 . . . . 10.0 116.024 -167.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -164.34 148.61 9.68 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.724 1.61 . . . . 10.0 109.766 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -20.62 65.28 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.326 1.232 . . . . 10.0 114.326 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.0 m -59.26 -44.25 92.42 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.08 -1.013 . . . . 10.0 111.254 171.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.03 -35.83 82.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.297 1.439 . . . . 10.0 111.045 177.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.507 HH12 HD22 ' A' ' 64' ' ' LEU . 8.1 tpm_? -60.08 -47.94 83.78 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.316 1.446 . . . . 10.0 111.239 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -59.31 -51.32 70.43 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.626 0.77 . . . . 10.0 111.485 170.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -43.71 81.39 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.826 1.65 . . . . 10.0 112.683 -174.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.6 -37.88 73.97 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.35 -48.75 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 118.639 0.654 . . . . 10.0 109.441 173.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.04 -49.78 76.58 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.369 0.668 . . . . 10.0 112.038 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.05 -59.16 5.14 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.091 0.956 . . . . 10.0 111.91 172.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.45 -35.62 79.86 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.406 1.003 . . . . 10.0 112.201 -176.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.74 -15.93 63.3 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.462 1.028 . . . . 10.0 112.976 177.129 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -109.84 20.56 17.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.059 1.343 . . . . 10.0 114.248 165.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.56 -1.18 14.15 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.596 1.558 . . . . 10.0 112.561 164.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.47 -4.36 57.33 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.798 -1.189 . . . . 10.0 113.053 173.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -154.9 3.34 0.21 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.104 1.362 . . . . 10.0 113.973 -159.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 127.755 2.422 . . . . 10.0 107.809 -173.232 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 110.623 -0.991 . . . . 10.0 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -136.76 135.94 38.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.537 1.535 . . . . 10.0 109.198 -161.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.9 t -54.33 -49.95 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.94 0.896 . . . . 10.0 111.08 -172.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.96 -56.31 19.0 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.674 1.59 . . . . 10.0 112.976 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.403 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 32.5 mtmm -61.01 -24.87 66.49 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 112.875 0.695 . . . . 10.0 112.875 175.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.48 -50.58 6.53 Favored Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.042 -1.223 . . . . 10.0 110.042 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -63.32 -43.16 98.59 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 118.911 1.355 . . . . 10.0 113.274 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -62.36 -39.21 92.39 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.134 0.879 . . . . 10.0 112.75 179.777 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -79.29 -36.07 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.792 0.724 . . . . 10.0 111.719 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -56.21 -48.85 75.63 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.997 0.919 . . . . 10.0 110.683 171.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.61 -15.58 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 113.609 0.966 . . . . 10.0 113.609 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -96.08 -33.72 11.99 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 123.946 0.898 . . . . 10.0 113.42 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.9 1.84 2.8 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 116.109 1.892 . . . . 10.0 116.109 -172.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -122.12 -49.2 2.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.013 1.725 . . . . 10.0 110.851 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.72 66.71 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.545 0.943 . . . . 10.0 113.545 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -46.07 -47.92 17.05 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.911 1.684 . . . . 10.0 112.057 171.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 98.5 m -89.22 -44.39 10.31 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 10.0 113.408 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 44.1 m80 -105.96 -10.02 16.8 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.607 2.077 . . . . 10.0 116.607 -162.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.308 11.1 t 37.42 -82.17 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 127.699 2.4 . . . . 10.0 116.732 -164.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.267 7.5 p 46.25 -51.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 131.35 3.86 . . . . 10.0 116.055 -161.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -20.11 0.1 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 131.487 3.915 . . . . 10.0 117.642 -168.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.4 pttm -152.49 22.57 0.62 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.844 1.658 . . . . 10.0 111.546 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.163 0 CA-C-O 121.891 0.717 . . . . 10.0 111.862 -165.479 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 m . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 115.46 1.652 . . . . 10.0 115.46 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.03 136.3 12.92 Favored Glycine 0 CA--C 1.542 1.769 0 CA-C-N 120.748 1.613 . . . . 10.0 111.65 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -59.66 1.57 0.39 Allowed 'Trans proline' 0 C--N 1.353 0.787 1 C-N-CA 127.2 5.266 . . . . 10.0 118.411 -173.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER 63.11 143.02 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.916 2.486 . . . . 10.0 114.12 -161.119 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.29 65.41 9.19 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.287 1.042 . . . . 10.0 110.913 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.81 163.58 1.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.048 1.339 . . . . 10.0 111.446 158.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.8 85.87 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.933 1.73 . . . . 10.0 116.267 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.18 -168.14 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.222 2.609 . . . . 10.0 113.215 169.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 55.02 35.28 24.33 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.819 2.448 . . . . 10.0 114.622 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 166.84 -19.64 0.09 OUTLIER Glycine 0 CA--C 1.531 1.075 0 N-CA-C 115.271 0.869 . . . . 10.0 115.271 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.422 ' HE ' ' HB2' ' A' ' 42' ' ' GLN . 4.2 ptm180 -74.58 -145.23 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.909 1.284 . . . . 10.0 110.994 164.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -151.85 -179.74 7.73 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.636 1.974 . . . . 10.0 109.072 171.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.2 p -59.8 158.32 10.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.448 1.118 . . . . 10.0 112.971 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.0 -8.24 78.75 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 116.96 1.544 . . . . 10.0 116.96 163.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.422 ' HB2' ' HE ' ' A' ' 38' ' ' ARG . 28.1 mm100 -71.13 -7.12 44.4 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.396 1.998 . . . . 10.0 116.396 -167.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.45 134.87 96.13 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.445 1.475 . . . . 10.0 111.275 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -76.77 155.67 34.97 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.014 1.809 . . . . 10.0 111.774 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 21.99 68.01 0.02 OUTLIER Glycine 0 CA--C 1.536 1.363 0 C-N-CA 128.765 3.079 . . . . 10.0 116.67 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -147.62 -42.58 0.17 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.673 0.99 . . . . 10.0 113.673 -172.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 m 60.02 83.76 0.13 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.159 2.184 . . . . 10.0 114.049 170.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -115.46 115.5 26.64 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 126.063 1.745 . . . . 10.0 112.86 -172.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.5 t 50.18 175.87 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.187 2.195 . . . . 10.0 115.119 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -78.49 -69.66 0.55 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.0 1.72 . . . . 10.0 112.316 161.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.36 -30.31 68.29 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.668 1.587 . . . . 10.0 114.21 -157.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.98 -63.42 1.16 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 119.008 0.822 . . . . 10.0 110.668 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -52.13 -43.16 63.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 119.082 -0.485 . . . . 10.0 110.432 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.67 -32.04 73.38 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.622 2.082 . . . . 10.0 116.622 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -54.43 -35.34 62.85 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.816 1.644 . . . . 10.0 113.673 -170.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.26 -9.49 47.67 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.56 1.552 . . . . 10.0 115.646 168.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.8 pp -63.0 159.93 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 126.336 1.854 . . . . 10.0 112.619 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -9.6 58.5 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.415 1.486 . . . . 10.0 114.936 -169.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.5 m95 45.28 97.42 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.556 2.742 . . . . 10.0 114.012 -162.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -161.59 -178.83 6.84 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.168 1.387 . . . . 10.0 109.917 -169.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -61.21 -29.62 69.93 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.667 1.729 . . . . 10.0 115.667 -155.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.49 -51.15 31.01 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 122.299 2.318 . . . . 10.0 111.484 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.4 p -72.32 -40.53 67.4 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.274 1.429 . . . . 10.0 113.153 -174.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.26 -30.24 64.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.977 0.911 . . . . 10.0 111.88 174.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 36.8 ttm -67.81 -48.7 65.5 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.493 -0.765 . . . . 10.0 109.565 169.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -54.3 -44.75 72.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.876 0.762 . . . . 10.0 110.916 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -69.39 -55.95 8.87 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.401 -0.809 . . . . 10.0 112.659 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.51 -11.03 60.49 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.814 1.643 . . . . 10.0 114.379 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -84.72 -29.46 25.53 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 120.507 1.503 . . . . 10.0 112.854 163.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.5 75.61 1.81 Allowed Pre-proline 0 CA--C 1.558 1.267 0 CA-C-N 119.106 0.866 . . . . 10.0 113.002 -172.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -71.3 -56.77 0.11 Allowed 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.486 2.124 . . . . 10.0 112.824 -163.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -65.02 -17.54 64.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.028 1.331 . . . . 10.0 113.905 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -76.34 -49.5 16.7 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.265 1.426 . . . . 10.0 111.586 165.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -62.93 -34.35 77.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.421 0.897 . . . . 10.0 113.421 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.84 125.45 7.46 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.393 1.477 . . . . 10.0 110.66 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.85 169.01 21.34 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.636 2.224 . . . . 10.0 112.657 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.31 -104.46 1.28 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.458 -1.457 . . . . 10.0 109.458 -166.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.4 m 59.93 -39.67 0.09 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 129.217 3.007 . . . . 10.0 118.364 165.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 59.97 -57.59 0.07 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 128.237 2.615 . . . . 10.0 116.311 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt -3.7 87.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 129.824 3.25 . . . . 10.0 113.772 -168.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.9 mp -77.23 70.4 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.82 1.648 . . . . 10.0 109.884 -166.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -163.01 -27.08 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.852 1.661 . . . . 10.0 113.02 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.86 -12.57 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 121.136 3.754 . . . . 10.0 121.136 172.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.34 -142.73 3.46 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 120.688 1.585 . . . . 10.0 111.808 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -144.71 165.12 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.805 0.842 . . . . 10.0 109.912 159.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -67.82 -21.33 65.22 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.852 1.797 . . . . 10.0 115.852 -167.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -163.07 140.68 7.84 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.416 1.486 . . . . 10.0 109.703 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -54.94 -41.79 71.49 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 -159.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -46.08 64.1 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.144 0.977 . . . . 10.0 111.159 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -58.03 -25.8 61.62 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.033 0.933 . . . . 10.0 112.305 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -29.05 59.85 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.853 0.861 . . . . 10.0 113.317 174.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -72.17 -47.19 52.66 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.592 1.157 . . . . 10.0 110.24 169.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.35 -39.41 79.44 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.647 1.179 . . . . 10.0 112.332 174.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.56 -48.45 79.31 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 168.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.7 mm -60.43 -45.14 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.078 0.854 . . . . 10.0 109.823 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.74 80.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.097 0.559 . . . . 10.0 112.453 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.7 -60.38 3.93 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.208 1.003 . . . . 10.0 112.075 174.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.27 -24.52 65.79 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -171.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -57.72 -55.02 40.25 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.884 0.765 . . . . 10.0 111.208 165.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -67.28 -33.19 74.78 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 117.853 -1.07 . . . . 10.0 113.505 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.12 -12.36 2.14 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.619 1.341 . . . . 10.0 114.619 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 p -76.63 -11.16 59.81 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.191 1.397 . . . . 10.0 114.209 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.26 9.45 0.42 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.048 1.339 . . . . 10.0 114.559 -168.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.973 2.909 . . . . 10.0 109.138 -174.054 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.427 0 CA-C-O 119.324 -0.709 . . . . 10.0 112.753 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.424 ' H ' ' HA ' ' A' ' 93' ' ' ASP . 1.0 OUTLIER -123.39 105.26 9.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 117.893 0.846 . . . . 10.0 109.671 -155.849 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.9 t -46.4 -48.98 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.57 1.548 . . . . 10.0 111.819 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -66.21 -34.7 78.62 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.096 1.358 . . . . 10.0 113.207 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -73.21 -31.64 64.29 Favored 'General case' 0 C--O 1.23 0.063 0 C-N-CA 123.803 0.841 . . . . 10.0 111.754 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.54 -42.14 56.06 Favored Glycine 0 C--O 1.226 -0.349 0 N-CA-C 109.588 -1.405 . . . . 10.0 109.588 -171.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -55.67 -48.16 75.51 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 171.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.65 66.83 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.685 0.994 . . . . 10.0 113.685 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.77 -40.18 76.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 119.658 1.117 . . . . 10.0 110.837 169.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.2 -55.17 30.54 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.709 0.686 . . . . 10.0 109.94 175.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.54 -8.83 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -96.63 -47.57 5.86 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.194 1.398 . . . . 10.0 111.567 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -117.58 -8.33 10.96 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.067 1.506 . . . . 10.0 115.067 -168.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -115.98 -44.56 2.91 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.582 1.553 . . . . 10.0 110.93 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.24 -8.07 5.18 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.81 1.041 . . . . 10.0 113.81 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.57 -15.51 58.27 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.477 1.511 . . . . 10.0 113.057 166.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -143.92 -44.87 0.27 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.934 1.694 . . . . 10.0 113.037 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -85.72 -164.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.768 2.027 . . . . 10.0 110.593 171.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 20' ' ' VAL . 1.4 t -150.19 -77.06 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.528 1.131 . . . . 10.0 111.153 168.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.505 ' H ' HG23 ' A' ' 19' ' ' THR 0.268 0.9 OUTLIER 49.75 -18.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 129.699 3.2 . . . . 10.0 117.204 -171.812 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -68.42 51.21 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 129.336 3.054 . . . . 10.0 113.315 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 mttm 57.71 -21.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 129.466 3.106 . . . . 10.0 117.013 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.176 0 C-N-CA 126.501 2.0 . . . . 10.0 112.637 175.804 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.723 -0.656 . . . . 10.0 111.884 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.06 150.85 17.27 Favored Glycine 0 CA--C 1.546 2.02 0 C-N-CA 124.666 1.127 . . . . 10.0 111.689 161.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -78.4 38.98 0.73 Allowed 'Trans proline' 0 CA--C 1.542 0.911 1 C-N-CA 125.354 4.036 . . . . 10.0 116.634 -163.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 56.42 -163.37 0.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.646 -1.284 . . . . 10.0 110.22 -161.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.56 27.44 1.53 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.28 1.832 . . . . 10.0 111.577 172.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.431 ' CE1' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER -53.14 107.26 0.22 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.635 2.374 . . . . 10.0 114.339 -176.908 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.03 11.34 58.35 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 126.084 1.802 . . . . 10.0 115.045 173.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 161.89 4.21 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.174 0.987 . . . . 10.0 110.403 166.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 62.77 44.43 6.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.564 1.546 . . . . 10.0 113.121 -155.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 164.08 -44.13 0.31 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.452 1.501 . . . . 10.0 111.034 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.405 HH21 ' HB3' ' A' ' 42' ' ' GLN . 25.0 mtp85 -82.24 159.09 23.29 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.411 0.624 . . . . 10.0 111.495 169.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -85.36 164.92 17.66 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.96 1.304 . . . . 10.0 111.66 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.9 t -60.65 151.35 29.35 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.882 1.273 . . . . 10.0 111.787 171.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.36 8.44 49.85 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 117.154 1.622 . . . . 10.0 117.154 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.431 HE21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -65.87 -15.73 63.19 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 115.604 1.705 . . . . 10.0 115.604 -171.258 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.38 109.43 1.37 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.452 1.901 . . . . 10.0 114.868 -162.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.04 52.92 3.99 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.469 3.446 . . . . 10.0 112.395 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 126.94 73.84 0.19 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.498 1.523 . . . . 10.0 112.328 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -157.2 -79.94 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.918 0.887 . . . . 10.0 111.485 171.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 24.7 m 55.28 102.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.511 1.525 . . . . 10.0 112.176 -155.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -55.03 4.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.582 1.953 . . . . 10.0 110.305 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 71.9 p -144.69 175.81 9.89 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.216 2.606 . . . . 10.0 108.04 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -76.6 -60.48 2.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.804 1.642 . . . . 10.0 112.84 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.16 -52.45 65.29 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.766 1.226 . . . . 10.0 113.883 -153.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -58.82 -58.87 6.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.599 0.76 . . . . 10.0 112.885 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -39.95 76.34 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.528 1.131 . . . . 10.0 113.139 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -61.67 -34.91 76.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.178 0.899 . . . . 10.0 113.241 173.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -75.13 -10.99 59.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.118 1.525 . . . . 10.0 115.118 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.06 12.29 57.23 Favored Glycine 0 CA--C 1.542 1.781 0 N-CA-C 117.663 1.825 . . . . 10.0 117.663 163.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -55.4 4.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 119.449 3.129 . . . . 10.0 119.449 -161.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 m 55.62 104.58 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.825 2.45 . . . . 10.0 114.625 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.53 119.49 16.82 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 121.182 -0.949 . . . . 10.0 111.777 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -163.81 167.84 20.34 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.593 1.157 . . . . 10.0 111.146 -155.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -68.61 23.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.81 2.844 . . . . 10.0 114.427 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -158.91 17.48 0.19 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.895 2.878 . . . . 10.0 110.651 -168.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.7 p -158.45 -37.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.244 1.818 . . . . 10.0 110.656 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.64 HD22 HH12 ' A' ' 91' ' ' ARG . 1.0 OUTLIER -75.38 -22.27 57.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 114.424 1.268 . . . . 10.0 114.424 174.636 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.7 mtm -67.76 -52.73 33.93 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.88 0.763 . . . . 10.0 110.686 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -61.97 -41.47 98.04 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.46 0.475 . . . . 10.0 110.527 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.76 -53.23 43.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 113.316 0.858 . . . . 10.0 113.316 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.7 tp -65.96 -33.47 75.9 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.062 1.301 . . . . 10.0 112.415 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -70.34 -28.3 65.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 172.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -161.38 75.94 2.42 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.626 1.17 . . . . 10.0 112.353 -172.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.99 -48.68 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.612 2.208 . . . . 10.0 111.93 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 32.38 0.08 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.35 2.26 . . . . 10.0 114.268 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.26 -43.65 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 128.006 2.522 . . . . 10.0 110.45 -167.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -68.06 -36.82 80.5 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 174.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.44 143.55 41.57 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.702 0.801 . . . . 10.0 111.224 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -76.72 158.75 35.4 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.151 2.568 . . . . 10.0 111.379 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 57.49 55.8 28.5 Favored Glycine 0 C--N 1.34 0.778 0 C-N-CA 123.868 0.747 . . . . 10.0 112.044 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -126.68 151.01 48.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.125 1.77 . . . . 10.0 109.445 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -142.55 5.92 1.63 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.332 1.453 . . . . 10.0 113.87 -169.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -54.75 92.64 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.746 1.618 . . . . 10.0 113.035 173.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.77 83.22 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.484 1.514 . . . . 10.0 110.069 175.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -162.3 -53.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.069 0.766 . . . . 10.0 113.069 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.71 87.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.078 2.551 . . . . 10.0 117.254 168.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.78 95.87 1.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 123.374 0.511 . . . . 10.0 112.134 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.65 -21.11 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -166.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 73.63 148.33 0.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.162 2.585 . . . . 10.0 110.943 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm 46.95 -13.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 130.554 3.541 . . . . 10.0 118.298 -162.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.6 mttm 49.11 -9.72 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 131.406 3.882 . . . . 10.0 118.754 163.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.0 m -63.9 -26.77 68.75 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 122.726 2.512 . . . . 10.0 111.188 156.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -53.29 -33.32 52.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.195 0.998 . . . . 10.0 112.955 163.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.64 HH12 HD22 ' A' ' 64' ' ' LEU . 3.9 tpm_? -66.59 -44.49 82.02 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 116.981 -1.485 . . . . 10.0 110.404 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.17 -45.42 93.15 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.419 1.009 . . . . 10.0 110.335 177.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.424 ' HA ' ' H ' ' A' ' 2' ' ' ASP . 77.2 m-20 -59.79 -49.42 77.8 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.467 1.507 . . . . 10.0 110.911 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -40.95 97.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.469 0.914 . . . . 10.0 113.469 174.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.8 mm -54.71 -56.2 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 171.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.54 42.76 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.028 0.931 . . . . 10.0 111.075 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.446 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 9.2 t80 -52.0 -59.11 4.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.081 1.752 . . . . 10.0 112.36 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.446 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 15.1 mt -71.51 -30.91 66.48 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.946 0.794 . . . . 10.0 113.01 -175.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.444 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -61.43 -52.97 62.37 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 118.995 0.816 . . . . 10.0 109.862 171.222 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -37.72 82.51 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 117.453 -1.26 . . . . 10.0 113.189 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.73 -7.18 4.45 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.8 p -69.41 -16.92 63.6 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.883 -1.136 . . . . 10.0 113.538 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -153.61 43.73 0.59 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.77 1.228 . . . . 10.0 111.8 -162.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 129.635 3.174 . . . . 10.0 110.506 163.276 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.019 0 N-CA-C 109.693 -1.363 . . . . 10.0 109.693 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -109.33 150.56 27.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.147 0.979 . . . . 10.0 111.562 -174.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.6 m -70.8 -40.27 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 121.244 -0.91 . . . . 10.0 112.24 -174.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 mp0 -59.12 -51.84 68.3 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.425 1.49 . . . . 10.0 110.288 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -56.93 -21.61 31.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.995 1.718 . . . . 10.0 114.167 174.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.74 -43.04 3.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 119.074 0.852 . . . . 10.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -60.8 -42.04 96.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.797 1.298 . . . . 10.0 112.757 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -36.51 81.8 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.55 1.14 . . . . 10.0 112.627 -176.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.569 HG23 HD11 ' A' ' 94' ' ' LEU . 9.8 tp -85.99 -34.53 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 124.059 0.944 . . . . 10.0 111.217 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -57.35 -50.88 71.54 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 118.929 0.786 . . . . 10.0 110.318 171.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.4 t -65.01 -8.1 5.05 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -97.67 -48.69 5.13 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.241 1.417 . . . . 10.0 112.56 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' HD11 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -121.75 -0.24 9.68 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.391 1.626 . . . . 10.0 115.391 -171.86 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.2 m -117.61 -43.47 2.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.862 1.265 . . . . 10.0 111.655 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.88 -10.09 8.47 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -16.62 52.6 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 10.0 112.854 167.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.1 m -143.24 -34.82 0.41 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.468 1.507 . . . . 10.0 114.002 -175.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -105.45 174.25 5.96 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.362 2.665 . . . . 10.0 111.837 -178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.0 m -160.92 90.29 0.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 119.735 -1.853 . . . . 10.0 112.732 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.8 p -95.76 -36.26 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 N-CA-C 114.103 1.149 . . . . 10.0 114.103 171.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.96 -0.73 12.22 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.838 -1.164 . . . . 10.0 114.061 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -151.54 -166.27 2.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.057 2.543 . . . . 10.0 107.115 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.692 0 N-CA-C 118.058 1.983 . . . . 10.0 118.058 -167.188 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 119.22 -0.419 . . . . 10.0 111.903 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -116.97 171.67 13.9 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 110.499 -1.04 . . . . 10.0 110.499 154.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -61.65 178.98 0.56 Allowed 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.846 5.031 . . . . 10.0 114.167 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -83.53 -10.24 58.43 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.325 1.602 . . . . 10.0 115.325 -168.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.4 mp 45.5 69.42 0.45 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.618 1.167 . . . . 10.0 110.59 -158.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.413 ' CE1' HH21 ' A' ' 38' ' ' ARG . 0.5 OUTLIER -55.56 -179.24 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.64 1.176 . . . . 10.0 111.51 163.19 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -36.53 137.92 0.45 Allowed Glycine 0 CA--C 1.538 1.523 0 O-C-N 121.491 -0.756 . . . . 10.0 112.356 161.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -151.86 171.74 17.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 130.064 3.346 . . . . 10.0 109.097 -167.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 68.38 86.19 0.13 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.03 1.732 . . . . 10.0 112.784 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.4 60.71 1.43 Allowed Glycine 0 CA--C 1.527 0.809 0 CA-C-N 115.016 -0.993 . . . . 10.0 112.989 172.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.413 HH21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -152.21 -94.26 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.494 1.118 . . . . 10.0 110.328 172.815 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -154.5 -129.41 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.651 1.18 . . . . 10.0 110.608 165.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.9 t -158.63 167.69 28.89 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 128.33 2.652 . . . . 10.0 108.082 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.18 46.29 4.17 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 115.98 1.152 . . . . 10.0 115.98 174.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -128.94 1.0 5.32 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.651 1.723 . . . . 10.0 115.651 -173.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.85 116.91 27.39 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 120.855 1.661 . . . . 10.0 112.225 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.83 -39.25 0.69 Allowed 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.495 2.13 . . . . 10.0 114.197 -158.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -119.15 49.08 0.89 Allowed Glycine 0 C--N 1.34 0.788 0 C-N-CA 124.439 1.018 . . . . 10.0 112.322 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -141.72 -41.04 0.36 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 118.384 -0.817 . . . . 10.0 113.172 -172.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 t 43.91 87.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.493 1.917 . . . . 10.0 115.297 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -172.9 4.03 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 126.647 1.979 . . . . 10.0 113.283 -172.306 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.7 p -64.13 155.45 31.49 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.222 -0.924 . . . . 10.0 111.793 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.18 -50.39 16.39 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.847 2.059 . . . . 10.0 112.41 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.32 30.64 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 128.379 2.672 . . . . 10.0 116.464 -164.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -161.23 -70.16 0.06 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.039 3.336 . . . . 10.0 107.145 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -55.3 22.59 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.997 1.719 . . . . 10.0 112.555 178.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.9 -32.34 73.8 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.269 0.94 . . . . 10.0 112.021 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -60.66 -16.56 40.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.011 1.325 . . . . 10.0 113.337 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.68 14.93 79.51 Favored Glycine 0 CA--C 1.535 1.308 0 N-CA-C 115.914 1.126 . . . . 10.0 115.914 163.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -55.45 0.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.219 2.607 . . . . 10.0 117.993 -167.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.8 m 55.47 107.51 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 128.941 2.896 . . . . 10.0 115.161 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -67.82 131.63 45.88 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.747 0.784 . . . . 10.0 112.576 170.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -165.1 162.66 20.35 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.348 1.459 . . . . 10.0 110.682 -155.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.35 35.28 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 129.399 3.08 . . . . 10.0 113.602 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -162.06 -74.54 0.05 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 128.235 2.614 . . . . 10.0 107.578 -164.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.4 p -57.88 -37.03 73.24 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.064 2.145 . . . . 10.0 112.582 -176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.42 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.92 -23.61 55.49 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.765 1.226 . . . . 10.0 113.68 176.024 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 35.7 mtm -71.99 -48.27 46.05 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.65 -0.656 . . . . 10.0 109.948 170.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -57.5 -51.79 68.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.657 1.183 . . . . 10.0 110.829 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -59.3 -52.03 67.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 118.308 -0.853 . . . . 10.0 112.44 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.404 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -63.36 -48.04 79.59 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.591 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HA ' ' HA2' ' A' ' 84' ' ' GLY . 14.1 mm-40 -62.6 -29.13 70.37 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.27 1.211 . . . . 10.0 114.27 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -162.25 97.71 1.17 Allowed Pre-proline 0 CA--C 1.546 0.8 0 CA-C-N 119.156 0.889 . . . . 10.0 112.01 161.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.14 -49.22 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.398 2.065 . . . . 10.0 110.838 -172.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -61.4 -23.19 65.63 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.956 1.702 . . . . 10.0 113.775 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -52.56 9.54 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.028 1.331 . . . . 10.0 112.273 163.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -61.85 -32.38 72.71 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.122 0.786 . . . . 10.0 113.122 -175.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.54 148.0 54.42 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 126.077 1.751 . . . . 10.0 110.82 172.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.42 -8.45 19.59 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.94 2.427 . . . . 10.0 114.094 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -141.25 78.52 0.29 Allowed Glycine 0 C--N 1.34 0.763 0 C-N-CA 123.938 0.78 . . . . 10.0 113.126 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.7 m -133.91 119.46 19.14 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.746 0.818 . . . . 10.0 113.091 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -85.99 6.12 30.18 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 116.016 1.858 . . . . 10.0 116.016 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.57 109.32 0.68 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.438 1.095 . . . . 10.0 111.364 173.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 26.0 mm -83.74 77.31 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 124.999 1.319 . . . . 10.0 110.035 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -163.85 -42.74 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 167.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.67 -146.19 0.2 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.296 1.038 . . . . 10.0 113.198 -162.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 69' ' ' GLU . . . -57.0 150.26 28.86 Favored Glycine 0 C--N 1.343 0.949 0 C-N-CA 124.607 1.099 . . . . 10.0 115.479 -163.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 tt -69.58 -9.86 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.552 1.316 . . . . 10.0 114.552 -163.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.2 tttm 56.68 51.11 11.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.686 1.994 . . . . 10.0 111.716 -178.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.31 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.046 1.738 . . . . 10.0 115.235 175.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 mptt 47.5 -56.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 129.441 3.096 . . . . 10.0 116.351 -162.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.5 m -58.66 -37.61 76.36 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 121.358 1.89 . . . . 10.0 112.495 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -52.75 -38.47 60.96 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.356 0.662 . . . . 10.0 111.86 171.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.42 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -61.17 -46.69 89.48 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.839 -1.163 . . . . 10.0 110.932 -178.919 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.95 -22.77 55.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.783 1.031 . . . . 10.0 113.783 175.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -62.85 -49.76 73.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.813 1.188 . . . . 10.0 110.264 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.569 HD11 HG23 ' A' ' 9' ' ' ILE . 3.6 mp -59.51 -40.58 87.58 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.148 -0.97 . . . . 10.0 113.29 174.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.59 -48.79 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 119.053 0.842 . . . . 10.0 109.022 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -50.23 74.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.101 0.409 . . . . 10.0 111.344 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -53.71 -55.73 23.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.006 1.323 . . . . 10.0 112.847 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.97 -28.71 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.326 0.966 . . . . 10.0 112.608 -175.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -66.63 -18.96 65.65 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.376 1.071 . . . . 10.0 112.625 171.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -85.95 -58.19 2.74 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 117.223 -1.37 . . . . 10.0 111.377 158.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.16 -18.62 37.85 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 115.948 1.833 . . . . 10.0 115.948 -170.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.2 t -64.19 -19.97 65.7 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.011 1.324 . . . . 10.0 114.509 166.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.22 -4.21 0.2 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.538 2.051 . . . . 10.0 116.538 -167.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 C--O 1.25 1.095 0 C-N-CA 126.155 1.782 . . . . 10.0 111.274 -171.525 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 CA-C-O 118.111 -1.383 . . . . 10.0 114.828 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -80.7 163.98 23.15 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.606 1.703 . . . . 10.0 111.442 166.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.03 -50.3 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.678 1.191 . . . . 10.0 110.597 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.36 -49.95 65.16 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.951 -1.093 . . . . 10.0 113.114 -170.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -57.29 -32.1 66.3 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.732 0.413 . . . . 10.0 111.527 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.34 -41.74 58.32 Favored Glycine 0 C--N 1.34 0.754 0 C-N-CA 124.535 1.064 . . . . 10.0 111.287 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -69.7 -33.8 73.02 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 118.15 0.975 . . . . 10.0 111.978 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -53.58 55.9 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.932 1.293 . . . . 10.0 110.311 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.96 -33.19 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 118.61 -0.709 . . . . 10.0 112.696 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.7 t80 -56.59 -54.08 50.18 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 119.725 1.148 . . . . 10.0 110.723 170.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.87 -10.09 6.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 112.932 0.715 . . . . 10.0 112.932 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -90.06 -52.32 5.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.195 1.398 . . . . 10.0 111.354 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -134.55 10.12 3.7 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -167.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.0 m -113.26 -42.29 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.11 1.364 . . . . 10.0 110.719 167.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.35 -14.61 19.54 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -66.13 -10.28 39.41 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.923 1.689 . . . . 10.0 114.741 168.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -143.43 -34.68 0.4 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.76 1.224 . . . . 10.0 112.98 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -114.41 -175.42 2.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.597 2.359 . . . . 10.0 111.956 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -146.04 176.74 9.49 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.317 0.647 . . . . 10.0 110.756 151.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.3 p -162.34 -41.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 127.139 2.176 . . . . 10.0 109.765 156.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -67.47 -51.9 45.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.996 0.918 . . . . 10.0 111.091 166.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -85.26 82.87 8.19 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.5 1.12 . . . . 10.0 110.158 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.23 0 C-N-CA 127.341 2.401 . . . . 10.0 115.757 167.567 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 119.499 -0.286 . . . . 10.0 110.957 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -144.51 175.92 23.97 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.814 2.15 . . . . 10.0 110.82 160.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.07 -179.18 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.273 3.982 . . . . 10.0 113.936 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -93.68 16.27 14.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.347 2.659 . . . . 10.0 115.741 -169.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp 38.85 55.1 2.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.99 2.116 . . . . 10.0 112.924 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -56.94 84.73 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.595 2.758 . . . . 10.0 114.112 -178.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.25 32.19 60.07 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.413 1.482 . . . . 10.0 114.962 166.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.0 179.25 0.71 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.183 0.993 . . . . 10.0 113.429 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.604 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 4.1 m-85 52.81 42.95 31.98 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 124.802 1.241 . . . . 10.0 111.068 -166.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 1.68 0.07 OUTLIER Glycine 0 CA--C 1.542 1.77 0 C-N-CA 126.945 2.212 . . . . 10.0 115.208 -163.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.9 mtp85 -152.41 163.33 39.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.118 1.767 . . . . 10.0 110.848 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -83.72 172.76 11.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.02 2.128 . . . . 10.0 112.999 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 50.6 p -81.73 179.63 7.75 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.581 1.152 . . . . 10.0 112.125 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.72 -32.1 4.07 Favored Glycine 0 CA--C 1.529 0.956 0 O-C-N 120.88 -1.137 . . . . 10.0 114.5 176.154 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 44.3 mm-40 -64.98 6.32 0.25 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 128.708 2.803 . . . . 10.0 116.623 -161.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.17 145.0 79.76 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 119.405 1.002 . . . . 10.0 108.939 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.57 70.31 4.97 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.415 2.743 . . . . 10.0 111.323 -177.055 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.35 -79.27 0.23 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.918 1.723 . . . . 10.0 111.987 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 48.62 -14.33 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 130.438 3.495 . . . . 10.0 117.883 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 m 76.38 75.82 0.09 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 129.787 3.235 . . . . 10.0 112.025 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -84.27 170.0 14.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.943 1.297 . . . . 10.0 111.849 159.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 82.1 p -69.59 -1.37 8.64 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 116.226 1.936 . . . . 10.0 116.226 -172.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.4 t70 46.3 -157.33 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.456 0.702 . . . . 10.0 110.912 -146.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.25 -76.12 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.357 2.663 . . . . 10.0 113.147 -168.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -49.94 -71.64 0.06 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.212 1.805 . . . . 10.0 111.4 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -57.07 -42.3 80.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.616 1.966 . . . . 10.0 111.246 -172.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.11 -59.9 3.61 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.591 2.356 . . . . 10.0 112.525 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -62.29 -52.01 65.41 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.905 0.882 . . . . 10.0 111.552 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.3 -179.99 19.01 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 122.436 1.02 . . . . 10.0 115.203 -172.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.07 -1.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 128.747 2.819 . . . . 10.0 112.544 -169.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.8 m 55.39 106.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.86 2.064 . . . . 10.0 113.181 -162.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -67.38 123.15 19.57 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.31 -0.869 . . . . 10.0 111.692 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -162.57 178.15 8.81 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.172 2.189 . . . . 10.0 110.907 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.91 41.93 0.05 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.127 2.971 . . . . 10.0 113.344 -174.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -161.64 -64.45 0.05 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.563 3.145 . . . . 10.0 108.396 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.1 p -62.48 -43.81 97.92 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.176 1.39 . . . . 10.0 112.416 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.69 -25.3 60.17 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.131 0.573 . . . . 10.0 111.405 173.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 34.3 ttm -63.95 -52.42 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.204 0.911 . . . . 10.0 109.234 170.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -60.86 -44.67 96.7 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.499 0.72 . . . . 10.0 111.146 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.29 -48.27 76.31 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.499 -0.762 . . . . 10.0 111.674 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -42.16 99.01 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.079 1.308 . . . . 10.0 111.066 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.97 -45.51 74.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.107 0.867 . . . . 10.0 112.282 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -160.6 76.77 2.62 Favored Pre-proline 0 CA--C 1.559 1.307 0 C-N-CA 124.656 1.182 . . . . 10.0 111.034 -163.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.92 -67.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.473 3.449 . . . . 10.0 114.271 -161.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -58.64 -20.29 46.56 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.176 1.79 . . . . 10.0 113.233 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -48.06 24.58 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.828 2.051 . . . . 10.0 111.428 170.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -61.19 -41.1 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.629 0.772 . . . . 10.0 112.855 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 pt -139.53 135.89 17.29 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.711 0.805 . . . . 10.0 111.208 -175.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -78.37 65.92 8.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.438 3.425 . . . . 10.0 112.786 -168.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.36 -145.96 4.65 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 126.423 1.963 . . . . 10.0 109.614 175.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 93.0 m 74.86 147.6 0.09 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.065 2.146 . . . . 10.0 114.636 168.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -141.56 21.6 2.18 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.946 2.098 . . . . 10.0 111.666 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 21.7 ttt -59.49 98.6 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.156 1.382 . . . . 10.0 109.561 158.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.5 mp -75.57 57.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.262 1.025 . . . . 10.0 110.3 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -163.64 107.05 0.99 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.29 1.036 . . . . 10.0 111.417 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.89 -162.04 0.2 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.096 1.358 . . . . 10.0 111.942 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.26 60.26 0.01 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 127.58 2.514 . . . . 10.0 117.051 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.331 5.6 tt 44.71 -122.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.343 2.657 . . . . 10.0 112.042 175.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -142.31 -73.8 0.3 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.31 1.444 . . . . 10.0 110.15 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.81 115.52 3.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 161.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -64.04 -21.71 66.62 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.133 0.879 . . . . 10.0 111.373 170.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.7 m -53.1 -50.91 63.46 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.145 0.978 . . . . 10.0 112.339 164.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.25 -30.36 66.49 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.551 1.069 . . . . 10.0 111.341 176.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -19.57 59.48 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.545 1.138 . . . . 10.0 113.869 173.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.76 -62.97 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.398 1.454 . . . . 10.0 108.189 160.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.58 -48.48 72.05 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 126.458 1.903 . . . . 10.0 111.198 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.2 tp -60.44 -47.7 84.96 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.7 mm -65.57 -44.02 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.905 -0.497 . . . . 10.0 110.075 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.53 -35.39 80.33 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.217 1.007 . . . . 10.0 111.609 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.445 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.0 t80 -57.12 -66.44 0.45 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.675 1.19 . . . . 10.0 110.952 165.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 51.7 mt -62.86 -29.9 71.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.604 ' HE2' ' HB3' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -57.46 -46.92 83.11 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.54 1.064 . . . . 10.0 110.983 172.519 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -91.22 -38.24 12.82 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 117.983 -1.008 . . . . 10.0 111.684 -172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.71 -13.33 9.53 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.837 1.655 . . . . 10.0 115.013 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.58 -2.38 14.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.581 1.152 . . . . 10.0 113.346 168.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -151.4 -53.8 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.73 2.012 . . . . 10.0 111.816 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 126.697 1.999 . . . . 10.0 113.215 -178.176 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.768 0 CA-C-O 118.716 -1.047 . . . . 10.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -136.82 155.2 50.11 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.475 0.917 . . . . 10.0 113.475 -144.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 94.6 t -58.57 -56.09 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 126.183 1.793 . . . . 10.0 111.544 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -59.46 -36.46 75.99 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.37 1.468 . . . . 10.0 112.004 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -77.75 -8.97 58.73 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.221 1.808 . . . . 10.0 114.666 174.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.23 -41.47 5.51 Favored Glycine 0 N--CA 1.471 1.0 0 CA-C-N 119.707 1.14 . . . . 10.0 112.092 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.08 68.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.726 -0.867 . . . . 10.0 113.036 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -30.07 67.71 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.492 1.293 . . . . 10.0 114.492 177.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -86.11 -31.1 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 119.026 0.83 . . . . 10.0 110.325 173.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t80 -58.08 -52.02 67.26 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 122.072 -0.393 . . . . 10.0 111.336 169.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.86 -9.89 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.366 0.876 . . . . 10.0 113.366 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -82.55 -52.18 7.08 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.055 0.942 . . . . 10.0 110.742 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -116.06 -52.67 2.59 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.285 1.034 . . . . 10.0 112.595 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 9.5 m -59.53 -43.01 93.59 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.902 0.881 . . . . 10.0 112.666 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.417 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -62.9 -12.2 23.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.658 1.355 . . . . 10.0 114.658 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.88 -14.77 63.11 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.618 1.099 . . . . 10.0 112.252 170.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 91.7 m -143.03 -26.95 0.58 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.665 1.358 . . . . 10.0 114.665 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -109.54 -56.26 2.33 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.201 1.4 . . . . 10.0 114.127 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.417 ' H ' ' HA ' ' A' ' 15' ' ' ALA 0.294 9.8 t 44.67 53.31 7.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.187 1.795 . . . . 10.0 114.016 -175.719 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.71 -28.38 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 120.789 -1.194 . . . . 10.0 112.752 175.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.82 4.74 0.26 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.542 1.937 . . . . 10.0 114.712 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -149.79 13.57 0.81 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.75 2.42 . . . . 10.0 111.501 169.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.173 0 C-N-CA 124.86 1.219 . . . . 10.0 112.957 -173.17 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 113.332 0.864 . . . . 10.0 113.332 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.99 165.82 21.65 Favored Glycine 0 CA--C 1.54 1.656 0 CA-C-N 119.645 1.111 . . . . 10.0 110.99 157.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -67.96 22.86 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.045 1 C-N-CA 126.478 4.785 . . . . 10.0 116.342 -173.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.349 0.0 OUTLIER 49.56 6.38 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 128.726 2.811 . . . . 10.0 117.931 -169.561 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.11 -34.21 0.28 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.728 2.411 . . . . 10.0 113.966 171.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.43 68.11 0.17 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 131.148 3.779 . . . . 10.0 114.13 169.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 32.85 68.05 0.18 Allowed Glycine 0 C--N 1.345 1.061 0 C-N-CA 127.587 2.517 . . . . 10.0 113.456 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -93.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.661 0.785 . . . . 10.0 112.322 -164.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 33.86 62.05 0.46 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.749 2.42 . . . . 10.0 115.358 161.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.35 -24.32 16.11 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.095 1.807 . . . . 10.0 114.151 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -68.06 168.18 12.5 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.955 1.378 . . . . 10.0 111.059 164.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -84.96 166.04 17.09 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.082 1.141 . . . . 10.0 114.082 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.4 p -67.55 -71.57 0.2 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 128.42 2.688 . . . . 10.0 112.964 -174.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -73.5 67.7 1.55 Allowed Glycine 0 C--N 1.339 0.703 0 C-N-CA 126.99 2.233 . . . . 10.0 112.988 -171.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.86 -2.98 7.73 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -173.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.06 118.84 59.47 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.551 1.14 . . . . 10.0 111.592 -176.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.89 81.75 1.86 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.069 2.513 . . . . 10.0 113.088 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.96 -7.75 70.09 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 125.403 1.478 . . . . 10.0 115.249 170.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -64.37 113.72 3.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.047 1.339 . . . . 10.0 110.615 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 m -71.18 142.55 50.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.399 1.48 . . . . 10.0 111.657 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.619 ' CG ' ' HE3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -155.0 178.41 10.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.082 1.142 . . . . 10.0 114.082 -169.221 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 p -67.52 120.93 14.77 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 10.0 111.924 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -75.07 36.38 0.11 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.676 1.59 . . . . 10.0 113.601 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.97 11.45 2.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.128 1.371 . . . . 10.0 114.625 -166.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.66 -33.97 0.05 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 117.905 -1.045 . . . . 10.0 113.791 -168.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HE3' ' CG ' ' A' ' 48' ' ' TYR . 1.7 mppt? -64.48 -48.81 73.83 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.763 1.165 . . . . 10.0 108.071 166.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -49.01 -34.89 14.07 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.133 3.773 . . . . 10.0 113.82 176.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -68.71 -16.36 63.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.832 1.049 . . . . 10.0 113.832 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.94 5.13 57.3 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.296 1.279 . . . . 10.0 116.296 165.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.9 pp -61.24 14.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 128.995 2.918 . . . . 10.0 116.706 -173.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 99.9 m 40.6 81.14 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.568 2.747 . . . . 10.0 112.504 155.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -54.6 137.08 44.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.167 1.387 . . . . 10.0 111.692 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.258 0.0 OUTLIER -161.46 -73.72 0.06 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.734 1.383 . . . . 10.0 114.734 -164.006 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -164.68 20.32 0.06 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 121.145 1.793 . . . . 10.0 113.092 -171.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -160.72 -63.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.963 1.305 . . . . 10.0 107.898 -162.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 46.3 p -60.81 -46.82 89.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 126.979 2.112 . . . . 10.0 110.651 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -28.86 66.47 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.932 1.293 . . . . 10.0 112.324 174.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.7 ttm -65.13 -51.13 63.1 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.053 0.541 . . . . 10.0 109.854 173.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -61.56 -46.18 90.99 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.269 1.028 . . . . 10.0 110.352 176.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.29 -53.01 50.31 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 118.585 -0.721 . . . . 10.0 112.799 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -26.44 66.71 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.257 1.389 . . . . 10.0 111.798 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.53 -25.2 45.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.976 1.473 . . . . 10.0 114.976 169.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.46 72.25 1.87 Allowed Pre-proline 0 CA--C 1.563 1.451 0 CA-C-N 119.746 1.157 . . . . 10.0 113.442 -174.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -71.5 -57.54 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.454 2.103 . . . . 10.0 113.283 -161.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.8 mttm -62.6 -27.88 69.5 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 127.081 2.153 . . . . 10.0 112.456 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.28 -46.62 32.38 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 126.284 1.834 . . . . 10.0 110.764 172.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -61.03 -49.29 78.01 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.271 0.841 . . . . 10.0 113.271 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 pt -135.97 131.29 18.86 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.661 0.784 . . . . 10.0 111.155 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -80.75 64.71 8.92 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.228 3.285 . . . . 10.0 113.33 -159.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 149.85 88.67 0.07 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 123.769 0.699 . . . . 10.0 111.59 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 19.0 m -143.89 100.26 3.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.616 1.166 . . . . 10.0 109.407 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -81.35 7.99 10.26 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.383 1.873 . . . . 10.0 115.0 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.3 ttt -50.14 107.55 0.17 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.106 0.866 . . . . 10.0 110.379 156.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.435 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.0 mp -78.49 59.2 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.936 1.295 . . . . 10.0 110.521 -175.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -162.93 92.44 0.77 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.307 1.043 . . . . 10.0 110.358 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.36 -14.62 60.48 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.453 1.649 . . . . 10.0 115.453 -172.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -179.95 159.09 23.22 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.753 1.168 . . . . 10.0 111.19 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' H ' ' A' ' 86' ' ' LYS 0.315 20.5 tt -96.06 -96.29 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 -168.255 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.665 ' H ' HG23 ' A' ' 85' ' ' ILE . 9.3 mmpt? -146.83 103.4 3.63 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.017 1.327 . . . . 10.0 110.995 -171.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 47.22 -73.7 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 129.352 3.061 . . . . 10.0 114.421 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -164.18 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.825 1.65 . . . . 10.0 112.931 157.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 m -52.71 -52.29 56.74 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.771 1.228 . . . . 10.0 112.592 -171.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -58.89 -26.37 64.22 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.984 0.811 . . . . 10.0 112.622 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -23.66 58.18 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.559 0.743 . . . . 10.0 112.251 176.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -70.28 -53.89 14.96 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.085 -1.009 . . . . 10.0 110.101 168.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.08 -47.32 78.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 10.0 110.544 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 45.5 tp -56.93 -48.29 78.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.735 1.614 . . . . 10.0 113.821 172.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 15.4 mm -61.69 -44.36 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 118.858 0.754 . . . . 10.0 109.911 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.22 84.05 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.548 0.739 . . . . 10.0 111.82 175.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -55.62 -60.51 3.33 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.52 0.728 . . . . 10.0 111.756 171.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.77 -21.65 62.48 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.794 1.179 . . . . 10.0 113.99 -172.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.76 -59.77 4.26 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.485 0.714 . . . . 10.0 109.989 159.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 mmtt -61.89 -28.23 69.36 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.36 -1.305 . . . . 10.0 113.387 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.72 -13.92 7.24 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.801 1.637 . . . . 10.0 114.698 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.8 p -74.61 -20.58 59.86 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.882 1.438 . . . . 10.0 114.882 166.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -155.8 15.87 0.36 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 115.175 1.546 . . . . 10.0 115.175 -164.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 115.314 -2.279 . . . . 10.0 113.819 173.636 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 111.013 -0.835 . . . . 10.0 111.013 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.06 151.51 28.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.32 2.248 . . . . 10.0 114.404 -163.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -58.13 -35.62 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 120.763 -1.21 . . . . 10.0 113.228 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 -63.81 -48.89 75.06 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.564 1.546 . . . . 10.0 111.216 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -57.57 -34.11 68.85 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.589 0.755 . . . . 10.0 111.574 172.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.79 -51.61 39.54 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.15 -1.18 . . . . 10.0 110.15 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.259 1.1 ptpm? -64.16 -38.25 90.39 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 118.401 1.101 . . . . 10.0 113.657 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.26 -37.7 78.06 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.595 1.089 . . . . 10.0 113.357 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mm -69.4 -39.99 79.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 120.025 1.284 . . . . 10.0 110.96 172.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -56.38 -49.01 75.69 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.544 -0.723 . . . . 10.0 110.35 174.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.15 -11.59 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.976 1.102 . . . . 10.0 113.976 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -84.95 -33.75 22.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.329 1.051 . . . . 10.0 112.275 -177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -132.02 -63.52 0.81 Allowed 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 126.159 1.784 . . . . 10.0 111.148 -172.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 m -53.64 -47.73 70.05 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.551 1.14 . . . . 10.0 112.784 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.24 -17.57 62.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.046 1.128 . . . . 10.0 114.046 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.01 -7.82 32.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.268 1.427 . . . . 10.0 112.781 174.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -141.67 -21.28 0.74 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.613 1.565 . . . . 10.0 113.186 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -126.23 -5.74 6.62 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -170.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.2 m 54.94 -79.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.934 2.093 . . . . 10.0 116.193 -177.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.8 t 46.95 -59.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.276 1 C-N-CA 131.711 4.004 . . . . 10.0 116.041 -167.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -71.72 14.05 0.23 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.511 1.924 . . . . 10.0 113.687 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -153.78 -166.53 2.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.474 2.71 . . . . 10.0 108.522 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.716 0 C-N-CA 125.552 1.548 . . . . 10.0 116.332 179.781 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 111.886 0.328 . . . . 10.0 111.886 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -138.8 173.66 22.48 Favored Glycine 0 CA--C 1.544 1.871 0 C-N-CA 126.51 2.005 . . . . 10.0 110.716 162.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 66.9 Cg_endo -71.64 -144.86 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.08 1 C-N-CA 125.379 4.052 . . . . 10.0 109.741 168.193 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -142.81 150.98 40.66 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 119.87 -1.769 . . . . 10.0 110.452 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.62 70.61 7.39 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 81.98 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 10.0 110.234 172.006 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.1 -67.78 0.48 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.584 2.516 . . . . 10.0 113.303 -176.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.11 -161.68 0.16 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.817 1.647 . . . . 10.0 111.064 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 60.43 64.37 1.22 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.204 1.801 . . . . 10.0 111.422 -173.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.7 42.58 0.86 Allowed Glycine 0 CA--C 1.532 1.151 0 CA-C-N 113.451 -1.704 . . . . 10.0 113.54 -172.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -150.95 150.5 30.89 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.21 1.404 . . . . 10.0 110.668 -177.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 163.59 18.41 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.909 1.077 . . . . 10.0 113.909 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.5 -16.62 58.61 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.278 1.831 . . . . 10.0 113.822 174.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.36 58.41 1.56 Allowed Glycine 0 CA--C 1.536 1.361 0 O-C-N 120.224 -1.547 . . . . 10.0 112.51 170.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -150.31 110.34 4.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.701 2.0 . . . . 10.0 112.238 -170.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.84 157.3 14.01 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.791 1.636 . . . . 10.0 110.376 165.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -84.81 -126.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 124.684 3.589 . . . . 10.0 109.215 159.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.92 79.78 0.37 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.368 1.461 . . . . 10.0 113.48 177.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.403 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 78.6 t80 -144.73 176.4 9.47 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.352 1.861 . . . . 10.0 110.714 172.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 96.7 m -154.39 100.03 2.25 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.881 -1.762 . . . . 10.0 110.832 171.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.61 167.64 16.07 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.338 2.255 . . . . 10.0 112.008 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.8 p -70.7 130.62 42.23 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.125 0.964 . . . . 10.0 111.051 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -33.2 71.86 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.364 1.616 . . . . 10.0 115.364 -162.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.25 -14.57 60.94 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.207 1.188 . . . . 10.0 114.207 -177.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -64.62 -70.06 0.25 Allowed 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.77 1.168 . . . . 10.0 110.244 169.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.16 -41.9 28.13 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.447 1.099 . . . . 10.0 112.104 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.17 -23.66 67.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.835 1.254 . . . . 10.0 114.002 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -74.01 -24.33 59.55 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.26 0.936 . . . . 10.0 112.677 170.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 65.32 12.62 56.22 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 116.844 1.498 . . . . 10.0 116.844 160.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.17 -12.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 129.221 3.008 . . . . 10.0 118.38 -160.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.0 m 56.73 118.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 128.197 2.599 . . . . 10.0 114.006 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 29.0 m95 -75.4 122.17 23.38 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.107 -0.951 . . . . 10.0 112.543 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -163.94 -177.94 5.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 130.207 3.403 . . . . 10.0 107.663 169.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -46.71 -57.94 4.35 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.956 1.253 . . . . 10.0 112.654 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -57.93 15.89 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 130.093 3.357 . . . . 10.0 116.691 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.8 p -158.15 -43.07 0.06 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.221 1.809 . . . . 10.0 109.976 -175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.82 -33.54 60.08 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.735 1.214 . . . . 10.0 113.102 174.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.6 tpp -65.93 -48.96 69.66 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.803 0.729 . . . . 10.0 109.472 174.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.74 -43.87 97.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.634 1.173 . . . . 10.0 109.953 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -58.02 -64.61 0.85 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.224 -0.893 . . . . 10.0 111.719 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -24.4 67.58 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.494 1.497 . . . . 10.0 113.686 -174.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -73.48 -22.87 60.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.745 1.387 . . . . 10.0 114.745 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.98 71.13 2.35 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 120.194 1.361 . . . . 10.0 111.487 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.68 -48.03 0.82 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.225 1.95 . . . . 10.0 111.506 -164.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.7 mtmt -70.28 33.43 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 128.313 2.645 . . . . 10.0 114.097 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -161.91 -39.14 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 127.114 2.165 . . . . 10.0 112.0 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -65.39 -34.21 77.78 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.169 0.44 . . . . 10.0 111.721 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.98 153.25 78.43 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.396 1.078 . . . . 10.0 111.022 171.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.38 93.81 0.75 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.058 3.172 . . . . 10.0 112.757 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.69 49.17 6.25 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.962 0.745 . . . . 10.0 114.962 161.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.1 m -65.39 -19.7 66.06 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.579 1.326 . . . . 10.0 114.579 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 64.87 -45.93 0.34 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.417 2.287 . . . . 10.0 115.653 -176.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.2 ttt 2.7 97.51 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 129.547 3.139 . . . . 10.0 115.393 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . 0.267 9.9 tp -76.12 74.72 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 122.547 1.165 . . . . 10.0 112.237 -178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -162.45 -66.6 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.35 1.86 . . . . 10.0 109.981 170.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.11 -0.56 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 119.927 3.306 . . . . 10.0 119.927 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.17 95.5 0.22 Allowed Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.765 1.621 . . . . 10.0 113.209 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 tp -67.27 159.46 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.904 0.882 . . . . 10.0 112.19 174.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -64.71 -42.03 95.58 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.946 1.298 . . . . 10.0 114.384 -174.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' THR . 3.6 ptpp? -162.97 170.21 18.42 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.585 1.954 . . . . 10.0 109.555 165.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -55.91 -32.1 63.46 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.408 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 12.4 m -56.87 -37.27 71.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.757 1.223 . . . . 10.0 113.235 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -77.19 -15.53 59.46 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.698 1.199 . . . . 10.0 114.147 171.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.477 HH21 HG12 ' A' ' 95' ' ' ILE . 0.0 OUTLIER -76.54 -48.76 18.33 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.237 -1.539 . . . . 10.0 110.866 166.429 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -54.53 -55.47 28.86 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.94 1.296 . . . . 10.0 111.775 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -63.69 -35.48 80.7 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.149 0.796 . . . . 10.0 113.149 -172.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.1 mp -62.08 -42.61 99.38 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.834 1.254 . . . . 10.0 112.687 170.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.477 HG12 HH21 ' A' ' 91' ' ' ARG . 21.8 mm -59.57 -50.89 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.592 0.633 . . . . 10.0 109.754 171.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.62 83.57 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.752 0.821 . . . . 10.0 112.045 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -56.6 -57.49 12.13 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.904 1.282 . . . . 10.0 111.635 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 82.3 mt -70.95 -25.88 62.92 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.927 1.239 . . . . 10.0 112.741 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? -61.07 -29.17 69.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.242 1.017 . . . . 10.0 112.637 165.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -76.54 -51.65 11.29 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 125.145 1.378 . . . . 10.0 110.989 163.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 98' ' ' LEU . . . -54.65 -22.51 13.85 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 121.474 1.943 . . . . 10.0 116.11 -174.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.8 0.73 12.24 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 169.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -153.92 -16.82 0.14 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 128.046 2.538 . . . . 10.0 115.499 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.255 1.356 0 C-N-CA 127.703 2.401 . . . . 10.0 111.792 -163.829 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.194 0 CA-C-O 118.217 -1.324 . . . . 10.0 113.642 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -134.55 118.0 16.79 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.627 . . . . 10.0 111.036 -139.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.7 p -50.27 -38.45 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.515 1.126 . . . . 10.0 112.658 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -59.78 -38.73 82.67 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.343 1.457 . . . . 10.0 113.724 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -73.98 -30.45 62.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.448 0.699 . . . . 10.0 110.766 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.47 -50.71 11.13 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 26.98 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.701 2.4 . . . . 10.0 115.146 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.01 -28.5 0.06 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.385 1.474 . . . . 10.0 112.693 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.4 tp -70.19 -37.24 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 120.775 1.625 . . . . 10.0 110.925 161.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -55.54 -51.0 68.53 Favored 'General case' 0 C--N 1.347 0.486 0 O-C-N 121.258 -0.901 . . . . 10.0 110.395 168.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 t -66.89 -8.33 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -96.19 -48.83 5.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.227 1.411 . . . . 10.0 112.169 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -125.07 6.26 7.91 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.668 1.729 . . . . 10.0 115.668 -166.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.4 m -122.61 -44.05 2.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.51 1.924 . . . . 10.0 111.011 172.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.68 -21.59 60.77 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -55.1 -11.61 0.73 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.894 2.078 . . . . 10.0 115.334 169.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.8 m -141.84 -30.22 0.59 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.079 1.752 . . . . 10.0 111.566 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -105.89 -20.43 13.44 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.656 1.354 . . . . 10.0 114.656 -176.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.1 p 56.13 12.96 1.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 118.364 2.727 . . . . 10.0 118.364 173.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.402 HG21 ' H ' ' A' ' 32' ' ' LEU . 4.0 t -66.29 165.45 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.273 1.829 . . . . 10.0 112.91 -173.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 87.95 0.15 0.44 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 130.14 3.376 . . . . 10.0 112.905 177.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -151.42 -172.1 4.12 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 128.493 2.717 . . . . 10.0 108.059 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.26 0 C-N-CA 125.221 1.391 . . . . 10.0 112.662 174.234 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 118.979 -0.534 . . . . 10.0 110.578 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.78 163.6 12.17 Favored Glycine 0 CA--C 1.544 1.871 0 N-CA-C 110.951 -0.86 . . . . 10.0 110.951 152.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.8 0.43 9.23 Favored 'Trans proline' 0 CA--C 1.538 0.683 1 C-N-CA 125.784 4.323 . . . . 10.0 116.571 -175.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 64.92 145.34 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.987 2.515 . . . . 10.0 114.056 -163.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.402 ' H ' HG21 ' A' ' 20' ' ' VAL . 1.8 mm? -85.26 73.29 10.61 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.225 -0.922 . . . . 10.0 109.493 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -161.93 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.469 0.707 . . . . 10.0 112.271 162.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.21 53.44 0.08 OUTLIER Glycine 0 CA--C 1.54 1.656 0 C-N-CA 127.473 2.463 . . . . 10.0 117.894 -164.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -70.8 177.9 3.37 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.033 2.533 . . . . 10.0 111.094 171.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.288 61.9 m-85 63.02 39.35 10.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.578 1.951 . . . . 10.0 112.24 -161.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.37 45.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.302 0 N-CA-C 116.3 1.28 . . . . 10.0 116.3 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.45 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -152.82 -99.45 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.498 1.649 . . . . 10.0 112.917 174.589 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.45 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -178.35 -165.94 0.1 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 131.563 3.945 . . . . 10.0 107.779 174.346 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.3 t -76.56 -140.7 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.446 1.098 . . . . 10.0 110.228 158.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.4 -69.48 3.36 Favored Glycine 0 CA--C 1.528 0.897 0 O-C-N 120.216 -1.553 . . . . 10.0 112.946 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -64.51 133.58 52.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.617 0.767 . . . . 10.0 111.648 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.85 110.75 0.84 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.93 2.092 . . . . 10.0 108.712 163.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.28 77.59 2.03 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.241 2.627 . . . . 10.0 114.498 -162.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.75 52.46 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.234 1.397 . . . . 10.0 114.587 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -64.16 -59.73 4.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.493 1.917 . . . . 10.0 114.347 -171.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m 77.52 127.07 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.165 2.586 . . . . 10.0 112.691 -164.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.17 -179.41 8.12 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.109 2.564 . . . . 10.0 111.061 -167.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -70.17 158.87 35.0 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.469 -0.769 . . . . 10.0 111.264 168.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.76 -41.98 35.7 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.888 1.811 . . . . 10.0 115.888 -176.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.02 -24.58 47.8 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.926 1.824 . . . . 10.0 115.926 -156.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -60.62 -53.4 57.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.849 0.86 . . . . 10.0 111.614 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.27 20.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.229 1.412 . . . . 10.0 111.926 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -58.1 -29.27 65.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.317 1.447 . . . . 10.0 113.727 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -72.91 -20.82 61.01 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.483 1.038 . . . . 10.0 113.759 178.251 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 59.06 11.08 10.51 Favored Glycine 0 CA--C 1.545 1.937 0 N-CA-C 119.217 2.447 . . . . 10.0 119.217 148.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.9 pt -50.33 -101.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 129.402 3.081 . . . . 10.0 115.796 -170.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -155.1 -27.42 0.11 Allowed 'General case' 0 N--CA 1.48 1.073 0 O-C-N 119.928 -1.733 . . . . 10.0 115.105 -173.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER 40.15 95.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.294 2.238 . . . . 10.0 113.757 -159.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -163.17 -175.04 4.1 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.267 2.627 . . . . 10.0 109.066 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -44.18 -53.89 6.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.224 2.21 . . . . 10.0 113.124 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.97 19.67 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.303 2.241 . . . . 10.0 116.199 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.3 p -160.05 -45.73 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.364 1.465 . . . . 10.0 110.716 -165.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.74 -22.24 56.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.634 1.174 . . . . 10.0 111.835 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -60.42 3.62 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.571 -0.9 . . . . 10.0 108.571 165.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.2 -37.68 83.86 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 110.538 -0.171 . . . . 10.0 110.538 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -70.43 -51.71 27.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 118.018 -0.991 . . . . 10.0 113.258 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.43 -34.05 76.43 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.356 1.889 . . . . 10.0 113.236 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -72.86 -29.58 63.3 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.101 0.778 . . . . 10.0 113.101 174.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.28 72.43 2.25 Favored Pre-proline 0 CA--C 1.561 1.374 0 N-CA-C 113.695 0.998 . . . . 10.0 113.695 -173.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.39 -50.31 0.73 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.736 2.958 . . . . 10.0 112.887 -165.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.74 -36.11 71.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.64 1.976 . . . . 10.0 112.921 177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -30.29 58.1 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.587 1.555 . . . . 10.0 112.793 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -75.78 -52.92 9.36 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.865 1.061 . . . . 10.0 113.865 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.0 pt -128.93 139.77 36.66 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 118.558 0.617 . . . . 10.0 112.279 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.55 146.89 56.54 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.939 2.426 . . . . 10.0 111.874 -168.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.13 10.84 10.32 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.82 1.2 . . . . 10.0 115.717 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.46 139.22 49.54 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.956 1.878 . . . . 10.0 110.4 175.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -84.8 -61.1 1.86 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 117.214 -1.374 . . . . 10.0 112.675 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.1 ttt 8.84 83.29 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 128.719 2.807 . . . . 10.0 114.098 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.24 74.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.307 1.443 . . . . 10.0 109.911 -171.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -163.15 -52.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.097 0.959 . . . . 10.0 112.911 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 40.15 82.82 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.261 2.225 . . . . 10.0 116.163 172.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.02 105.27 2.86 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.171 0.891 . . . . 10.0 111.781 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.2 tt -62.55 -50.86 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.864 -0.786 . . . . 10.0 112.494 -172.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.0 mttt 161.45 174.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 1 C-N-CA 132.291 4.236 . . . . 10.0 109.299 161.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 10.5 mmpt? 43.64 -98.59 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.962 2.505 . . . . 10.0 112.195 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.85 -49.0 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 129.681 3.192 . . . . 10.0 109.519 173.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 m -49.82 -46.66 51.36 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.736 2.014 . . . . 10.0 112.669 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -56.94 -35.97 69.71 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.108 0.963 . . . . 10.0 112.159 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -41.0 63.4 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.512 0.597 . . . . 10.0 111.032 175.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.04 -47.1 78.5 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 118.724 0.693 . . . . 10.0 111.997 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -57.14 -45.86 83.18 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.534 1.534 . . . . 10.0 111.818 174.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.02 -47.15 78.36 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 124.455 1.102 . . . . 10.0 113.364 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.5 mm -62.61 -46.06 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 118.355 -0.831 . . . . 10.0 109.145 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.05 82.52 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.966 0.803 . . . . 10.0 112.576 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.02 -63.19 1.17 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.281 1.032 . . . . 10.0 112.572 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.06 -37.63 80.42 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.787 0.835 . . . . 10.0 112.644 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -59.28 -16.94 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.126 0.97 . . . . 10.0 113.392 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -102.61 -45.04 5.16 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 117.529 -1.224 . . . . 10.0 113.725 160.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.58 62.77 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.57 1.692 . . . . 10.0 115.57 -173.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.8 p -72.37 -10.39 59.72 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.869 -1.144 . . . . 10.0 113.931 171.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -154.05 24.77 0.49 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.997 1.719 . . . . 10.0 111.938 -163.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . 0.253 5.4 pt-20 . . . . . 0 C--O 1.248 1.024 0 C-N-CA 126.387 1.875 . . . . 10.0 115.233 -159.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 110.433 -1.067 . . . . 10.0 110.433 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -150.31 169.72 20.71 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.351 1.46 . . . . 10.0 110.248 -177.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.7 t -58.11 -57.11 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.845 1.258 . . . . 10.0 109.803 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.464 ' OE2' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -62.85 -39.1 93.35 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.117 1.367 . . . . 10.0 113.995 179.255 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.65 -29.79 70.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.236 -0.888 . . . . 10.0 112.345 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -89.83 -43.21 5.17 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 124.92 1.248 . . . . 10.0 112.503 -170.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.464 ' HE2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.544 -0.974 . . . . 10.0 112.606 175.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -35.81 79.59 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.09 -0.957 . . . . 10.0 112.967 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.7 tp -78.2 -33.22 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.728 1.149 . . . . 10.0 110.889 176.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -57.07 -52.9 63.42 Favored 'General case' 0 C--N 1.342 0.263 0 O-C-N 121.224 -0.923 . . . . 10.0 110.437 166.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.4 t -65.8 -9.02 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 O-C-N 121.336 -0.853 . . . . 10.0 113.166 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.96 -37.79 10.05 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.662 1.585 . . . . 10.0 112.047 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptm -124.03 -14.08 7.17 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.817 1.414 . . . . 10.0 114.817 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.5 m -119.86 -39.89 2.8 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.772 1.629 . . . . 10.0 111.725 -172.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.485 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -56.96 -20.23 22.52 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 168.351 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -21.05 2.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.692 1.997 . . . . 10.0 113.602 168.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.0 m -143.13 -28.83 0.55 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.555 1.542 . . . . 10.0 114.759 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.46 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 91.3 m-70 -103.49 -55.73 2.34 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.591 1.33 . . . . 10.0 114.591 -169.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.485 ' H ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 m 35.11 84.35 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.593 2.757 . . . . 10.0 114.173 -168.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.63 -34.09 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.361 1.065 . . . . 10.0 112.545 164.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -95.1 154.8 17.0 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.921 0.711 . . . . 10.0 112.921 -156.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.8 mttp 50.98 -120.84 1.69 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.165 1.386 . . . . 10.0 110.485 176.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.261 0 C-N-CA 124.549 1.071 . . . . 10.0 112.405 172.713 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.46 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -129.15 172.05 19.81 Favored Glycine 0 CA--C 1.539 1.569 0 N-CA-C 109.525 -1.43 . . . . 10.0 109.525 152.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -71.65 163.58 38.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 120.286 2.043 . . . . 10.0 110.033 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -72.03 7.76 1.52 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.825 1.787 . . . . 10.0 115.825 -167.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mp 40.3 73.68 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.219 1.408 . . . . 10.0 111.587 -165.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -53.34 -164.51 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.894 2.878 . . . . 10.0 113.243 173.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.72 58.72 0.05 OUTLIER Glycine 0 CA--C 1.541 1.658 0 O-C-N 120.011 -1.681 . . . . 10.0 113.149 163.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tp -69.76 -38.47 76.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 128.679 2.792 . . . . 10.0 113.832 -161.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -66.21 95.95 0.32 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.457 1.503 . . . . 10.0 110.29 -175.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.72 13.85 9.99 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.225 1.393 . . . . 10.0 114.678 -173.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.6 ptm85 -150.64 -176.61 5.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.413 2.107 . . . . 10.0 114.74 -175.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -74.6 161.75 29.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.973 2.109 . . . . 10.0 113.837 -163.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.57 -34.74 25.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.56 1.944 . . . . 10.0 113.315 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.92 2.58 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 119.908 -1.745 . . . . 10.0 112.696 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.81 -5.01 1.05 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 118.057 2.614 . . . . 10.0 118.057 -168.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.92 113.75 27.86 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 125.807 1.643 . . . . 10.0 114.424 -167.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -79.22 57.25 6.39 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.552 3.501 . . . . 10.0 113.211 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.59 67.2 0.23 Allowed Glycine 0 N--CA 1.471 1.031 0 C-N-CA 124.527 1.061 . . . . 10.0 112.989 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -144.9 177.76 8.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.352 1.461 . . . . 10.0 109.255 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.2 t -152.77 123.85 7.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.271 1.028 . . . . 10.0 109.686 -177.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.19 172.48 18.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.492 1.517 . . . . 10.0 112.705 -159.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.4 p -74.81 107.12 6.7 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.541 -0.725 . . . . 10.0 110.902 177.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -75.21 83.35 2.38 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 122.489 1.138 . . . . 10.0 112.877 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -139.27 -46.21 0.46 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.096 1.758 . . . . 10.0 108.924 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -45.5 -67.04 0.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.373 2.269 . . . . 10.0 111.024 161.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -57.0 -49.33 76.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.265 0.939 . . . . 10.0 111.727 -178.429 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.69 -17.38 3.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.317 1.847 . . . . 10.0 115.012 173.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.16 60.08 0.29 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.345 0.975 . . . . 10.0 111.002 -169.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.06 -160.39 4.68 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.882 1.706 . . . . 10.0 115.527 173.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.3 pp -169.99 5.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 126.887 2.075 . . . . 10.0 112.698 -150.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.6 m 56.0 118.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.923 2.089 . . . . 10.0 113.645 -163.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -69.53 121.98 18.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.73 -1.231 . . . . 10.0 110.441 168.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -171.03 -179.05 2.63 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.349 1.859 . . . . 10.0 111.439 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -62.06 27.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 131.177 3.791 . . . . 10.0 115.46 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -160.07 9.28 0.1 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.254 2.222 . . . . 10.0 112.089 -167.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.2 p -157.71 -26.78 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.911 -1.118 . . . . 10.0 111.767 -165.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.8 -28.41 60.71 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 117.833 -1.079 . . . . 10.0 112.843 164.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -62.66 -54.3 41.5 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.684 1.129 . . . . 10.0 109.217 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 tp10 -64.07 -41.71 97.25 Favored 'General case' 0 N--CA 1.463 0.195 0 O-C-N 123.527 0.517 . . . . 10.0 110.017 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.64 -48.57 74.33 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.644 -0.693 . . . . 10.0 112.34 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -59.31 -53.96 52.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.288 1.403 . . . . 10.0 110.174 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.39 -18.63 63.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.883 1.438 . . . . 10.0 114.883 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.19 67.45 2.36 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 123.845 0.858 . . . . 10.0 111.803 -176.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.9 -63.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.576 2.851 . . . . 10.0 113.384 -164.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.56 -20.76 65.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.629 1.571 . . . . 10.0 113.473 -178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.88 -51.36 12.67 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.715 2.006 . . . . 10.0 111.275 168.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -60.35 -44.51 95.49 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.83 0.852 . . . . 10.0 112.767 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.34 133.59 20.65 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 124.005 0.922 . . . . 10.0 110.407 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.17 67.75 8.49 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.902 3.068 . . . . 10.0 113.9 -158.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -179.21 -115.31 0.46 Allowed Glycine 0 CA--C 1.524 0.617 0 C-N-CA 124.919 1.247 . . . . 10.0 110.037 167.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.254 36.9 m 67.85 155.89 0.11 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 128.989 2.915 . . . . 10.0 115.013 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mmtt -140.68 19.64 2.35 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.117 1.767 . . . . 10.0 112.601 -175.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.7 ttt -67.78 79.95 0.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.558 1.543 . . . . 10.0 111.398 166.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 71.7 mt -71.14 78.1 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 124.88 1.272 . . . . 10.0 109.87 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -164.09 -40.55 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.022 2.529 . . . . 10.0 110.501 170.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.98 -128.69 1.31 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.299 1.44 . . . . 10.0 112.945 -167.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.59 162.89 53.49 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-O 122.271 0.928 . . . . 10.0 115.131 -162.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.5 tp -80.83 3.91 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 113.757 1.021 . . . . 10.0 113.757 -168.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 62.4 0.65 0.63 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.571 2.348 . . . . 10.0 115.695 172.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -160.37 -144.97 0.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 129.983 3.313 . . . . 10.0 106.847 -163.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.64 -31.73 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 122.953 2.615 . . . . 10.0 117.888 -176.074 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -61.8 -34.52 76.06 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 121.604 2.002 . . . . 10.0 110.931 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.4 pm0 -75.31 -4.43 39.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.914 2.485 . . . . 10.0 114.731 170.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.4 tpm_? -72.45 -58.25 3.54 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 120.77 -1.206 . . . . 10.0 109.852 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -75.57 -29.7 59.42 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 117.076 -1.44 . . . . 10.0 114.29 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 9.6 p30 -65.06 -42.19 94.45 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.789 2.086 . . . . 10.0 112.7 177.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -55.54 -48.27 74.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.753 1.621 . . . . 10.0 112.532 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.7 mm -61.6 -48.1 90.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 118.872 -0.585 . . . . 10.0 109.642 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.3 91.07 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.638 0.775 . . . . 10.0 112.099 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -60.71 -61.93 2.23 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.846 1.258 . . . . 10.0 111.745 173.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.58 -39.73 94.64 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 118.131 -0.938 . . . . 10.0 112.029 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -16.14 63.2 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.694 1.133 . . . . 10.0 113.352 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -89.2 -58.43 2.54 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 124.24 1.016 . . . . 10.0 109.524 162.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.31 -19.1 32.18 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 115.776 1.769 . . . . 10.0 115.776 -173.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 p -65.71 -11.27 43.87 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.35 1.46 . . . . 10.0 114.589 167.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.98 -15.5 0.14 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.198 1.799 . . . . 10.0 115.028 -168.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 . . . . . 0 C--O 1.244 0.81 0 C-N-CA 126.389 1.875 . . . . 10.0 111.523 -170.132 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.988 0 CA-C-O 118.953 -0.915 . . . . 10.0 113.456 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.446 ' HB2' ' HE3' ' A' ' 5' ' ' LYS . 4.7 m-20 -135.34 139.96 44.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.651 1.58 . . . . 10.0 110.778 178.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.6 p -62.98 -43.66 99.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 -172.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.0 mp0 -61.74 -53.01 61.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.904 0.882 . . . . 10.0 110.795 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 2' ' ' ASP . 4.3 mtmp? -60.88 -20.88 62.67 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.922 1.082 . . . . 10.0 113.922 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -91.58 -38.03 5.98 Favored Glycine 0 C--N 1.337 0.62 0 CA-C-N 119.129 0.877 . . . . 10.0 112.647 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -28.51 65.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.103 1.452 . . . . 10.0 112.473 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HZ1' ' CD ' ' A' ' 90' ' ' GLU . 1.6 pttm -60.92 -50.69 72.39 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.826 0.739 . . . . 10.0 111.629 172.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -67.11 -37.16 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 118.515 0.598 . . . . 10.0 110.864 178.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.8 t80 -55.7 -52.0 65.39 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-N 118.082 0.401 . . . . 10.0 110.541 170.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.42 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.4 t -65.95 -11.67 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -95.34 -32.47 12.94 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.89 1.276 . . . . 10.0 112.638 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -122.12 -56.98 1.8 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.883 1.273 . . . . 10.0 111.333 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 12.6 m -67.1 -51.52 53.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.864 1.666 . . . . 10.0 112.6 -171.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.46 -11.03 39.2 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 -172.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.57 -56.42 21.52 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.17 1.388 . . . . 10.0 109.531 166.196 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.3 m -85.25 -37.43 20.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.02 1.328 . . . . 10.0 112.556 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -120.82 44.89 2.37 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 127.079 2.152 . . . . 10.0 112.973 -163.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -57.86 125.19 21.98 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 119.872 -1.768 . . . . 10.0 111.537 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.78 -38.24 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-O 117.248 -1.358 . . . . 10.0 114.518 -168.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -11.84 37.81 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 121.46 1.936 . . . . 10.0 114.605 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -152.02 152.01 31.89 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 128.221 2.608 . . . . 10.0 107.944 167.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.236 0 C-N-CA 125.07 1.319 . . . . 10.0 114.504 177.25 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.49 159.0 19.99 Favored Glycine 0 CA--C 1.545 1.914 0 CA-C-N 120.941 1.7 . . . . 10.0 112.199 164.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.73 168.87 23.38 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 125.079 3.852 . . . . 10.0 113.537 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.51 123.41 19.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.63 -1.294 . . . . 10.0 108.336 162.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.74 93.27 0.1 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.303 1.041 . . . . 10.0 109.096 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -170.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.261 3.024 . . . . 10.0 113.448 -178.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.89 53.34 0.1 OUTLIER Glycine 0 CA--C 1.541 1.698 0 C-N-CA 126.424 1.964 . . . . 10.0 114.816 172.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mp -68.63 177.58 2.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 129.594 3.158 . . . . 10.0 112.931 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 64.18 59.7 1.03 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.232 1.813 . . . . 10.0 110.504 -166.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.17 16.84 0.26 Allowed Glycine 0 CA--C 1.535 1.283 0 N-CA-C 116.725 1.45 . . . . 10.0 116.725 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.0 ptm85 -152.88 168.78 24.64 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.326 2.063 . . . . 10.0 112.969 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.75 173.86 11.16 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.472 1.909 . . . . 10.0 113.554 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 77.6 p -69.65 172.57 7.24 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.583 1.953 . . . . 10.0 111.541 159.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.35 51.24 4.45 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.201 -0.937 . . . . 10.0 114.603 171.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -11.22 2.85 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.601 1.334 . . . . 10.0 114.601 -164.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.62 140.77 92.3 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 123.35 0.66 . . . . 10.0 112.036 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.03 63.38 8.74 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.558 2.838 . . . . 10.0 112.24 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.24 64.54 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.371 0.986 . . . . 10.0 114.978 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -67.32 170.36 7.38 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 118.424 1.112 . . . . 10.0 112.115 170.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.4 t -152.72 138.35 17.81 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.075 -1.015 . . . . 10.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 -96.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.464 1.506 . . . . 10.0 111.378 -154.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.2 p -142.24 136.89 30.29 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.599 1.559 . . . . 10.0 109.74 167.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -74.75 -31.05 61.69 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.087 -0.506 . . . . 10.0 112.339 177.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.26 -29.83 70.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.505 1.922 . . . . 10.0 113.299 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -72.8 -74.77 0.16 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.48 0.712 . . . . 10.0 109.542 160.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.412 ' HZ1' ' CG ' ' A' ' 50' ' ' ASP 0.307 0.0 OUTLIER -60.24 -31.64 70.39 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.324 1.601 . . . . 10.0 115.324 -157.133 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.37 -22.89 65.55 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.876 1.435 . . . . 10.0 114.876 173.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.67 -36.29 83.22 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.582 1.083 . . . . 10.0 110.797 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.75 13.49 69.68 Favored Glycine 0 CA--C 1.533 1.165 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 165.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.4 pt -51.61 140.47 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 125.931 1.692 . . . . 10.0 111.85 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.1 m -76.13 108.53 9.11 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.418 0.628 . . . . 10.0 109.783 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -69.98 114.89 8.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.947 0.899 . . . . 10.0 111.33 173.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -163.85 -174.53 3.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.316 3.046 . . . . 10.0 109.294 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.22 -54.36 44.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.215 -0.928 . . . . 10.0 111.849 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -62.88 20.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.982 2.913 . . . . 10.0 115.467 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.4 p -158.37 -36.84 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.463 1.905 . . . . 10.0 111.228 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mp -73.92 -30.76 62.74 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 121.051 1.75 . . . . 10.0 112.642 166.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.1 ttm -64.27 -52.62 57.76 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.559 0.618 . . . . 10.0 109.487 175.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.65 -38.41 91.01 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.339 0.656 . . . . 10.0 110.647 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -64.21 -61.9 1.96 Allowed 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.451 -0.785 . . . . 10.0 112.323 175.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.0 tp -66.49 -30.11 70.37 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 120.323 1.42 . . . . 10.0 113.42 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -68.93 -24.49 64.29 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 119.01 0.823 . . . . 10.0 112.809 172.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.25 77.94 2.02 Favored Pre-proline 0 CA--C 1.556 1.208 0 N-CA-C 114.609 1.337 . . . . 10.0 114.609 172.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.79 -41.43 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 121.883 1.722 . . . . 10.0 112.143 -166.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.446 ' HE2' ' CB ' ' A' ' 83' ' ' ALA . 33.3 mttm -67.58 23.28 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.318 2.647 . . . . 10.0 114.777 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.4 mttm -161.36 -31.97 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.555 2.342 . . . . 10.0 111.932 -170.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -68.51 -31.63 71.02 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.276 0.944 . . . . 10.0 113.321 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 pt -135.81 151.84 74.82 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.889 1.276 . . . . 10.0 110.808 177.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.98 22.17 0.49 Allowed 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.29 3.326 . . . . 10.0 115.91 -159.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.4 100.47 0.17 Allowed Glycine 0 CA--C 1.524 0.638 0 O-C-N 121.206 -0.934 . . . . 10.0 112.663 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.32 -27.53 2.42 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.066 1.506 . . . . 10.0 115.066 -172.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.63 -70.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 116.566 -1.683 . . . . 10.0 112.831 -170.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.6 ttt 23.3 92.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 129.535 3.134 . . . . 10.0 113.914 -176.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.8 mt -70.31 70.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 125.741 1.616 . . . . 10.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -162.76 -70.16 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.458 1.903 . . . . 10.0 110.445 169.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.446 ' CB ' ' HE2' ' A' ' 72' ' ' LYS . . . 45.51 87.09 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.72 2.408 . . . . 10.0 116.732 171.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.65 93.63 2.26 Favored Glycine 0 C--N 1.341 0.843 0 C-N-CA 124.472 1.034 . . . . 10.0 111.181 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -66.54 156.24 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 122.34 1.067 . . . . 10.0 113.166 -175.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -59.98 -20.92 60.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.142 2.177 . . . . 10.0 115.356 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -161.51 133.84 5.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.998 2.119 . . . . 10.0 109.392 -165.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.75 -57.33 13.39 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.113 0.965 . . . . 10.0 112.79 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.4 m -50.72 -43.8 57.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.004 1.321 . . . . 10.0 112.278 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.488 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 60.0 mm-40 -59.41 -34.74 72.84 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.394 1.078 . . . . 10.0 112.734 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.471 HH21 HD12 ' A' ' 95' ' ' ILE . 1.3 ttp-105 -70.49 -34.19 72.09 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.127 1.33 . . . . 10.0 112.545 172.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.35 -46.8 72.32 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 174.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -56.57 -52.12 66.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.602 1.561 . . . . 10.0 113.408 171.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 23.3 tp -53.12 -49.44 66.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.714 1.605 . . . . 10.0 113.521 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.471 HD12 HH21 ' A' ' 91' ' ' ARG . 12.1 mt -62.12 -39.28 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-O 119.176 -0.44 . . . . 10.0 110.685 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.44 87.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.562 0.619 . . . . 10.0 112.6 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -56.22 -56.3 22.62 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 117.841 -1.076 . . . . 10.0 111.281 169.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.14 -34.46 78.44 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 120.029 1.286 . . . . 10.0 112.37 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -59.42 -25.52 64.39 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 171.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -93.75 -62.06 1.43 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.741 1.616 . . . . 10.0 112.057 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.96 -11.17 12.03 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.803 1.779 . . . . 10.0 115.803 -164.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 p -81.27 -6.6 59.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -153.56 -10.45 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.187 1.795 . . . . 10.0 114.999 -169.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.249 1.046 0 C-N-CA 127.798 2.439 . . . . 10.0 110.725 -177.413 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 119.46 -0.633 . . . . 10.0 112.002 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -136.65 132.11 34.56 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.118 0.967 . . . . 10.0 111.159 -157.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.48 -54.96 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 125.428 1.491 . . . . 10.0 111.422 -167.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.22 -27.63 66.53 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 115.565 1.691 . . . . 10.0 115.565 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -64.23 -42.6 96.49 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.337 0.517 . . . . 10.0 109.611 163.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.56 -41.98 49.34 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 124.348 0.975 . . . . 10.0 111.377 -170.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -45.17 -59.62 2.54 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 126.987 2.115 . . . . 10.0 111.287 173.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -71.89 -42.3 66.95 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.314 1.046 . . . . 10.0 112.085 -172.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.84 -37.46 79.93 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 118.767 0.712 . . . . 10.0 111.351 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -56.02 -52.24 64.93 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 119.107 0.867 . . . . 10.0 110.107 167.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.414 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.5 t -61.36 -14.33 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -92.52 -38.51 11.89 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.472 1.509 . . . . 10.0 112.169 -177.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -130.23 0.09 4.61 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.769 1.766 . . . . 10.0 115.769 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.1 m -131.8 -43.48 0.99 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.241 1.417 . . . . 10.0 112.592 -176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.64 -25.52 67.4 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.135 -0.978 . . . . 10.0 112.821 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -1.57 0.24 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.542 2.337 . . . . 10.0 114.791 170.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.3 m -143.16 -33.16 0.45 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.004 2.122 . . . . 10.0 112.468 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -115.25 -10.21 12.13 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.018 1.727 . . . . 10.0 115.271 -174.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 p 57.6 -68.17 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 128.661 2.784 . . . . 10.0 117.487 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.3 t 39.22 -96.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 128.954 2.902 . . . . 10.0 112.33 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -65.74 -17.46 64.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.472 1.109 . . . . 10.0 112.605 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -80.39 59.53 3.49 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.604 -1.31 . . . . 10.0 110.974 166.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.18 0 C-N-CA 126.1 1.81 . . . . 10.0 114.633 173.856 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.373 0.508 . . . . 10.0 112.373 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -132.8 173.86 20.74 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 125.583 1.563 . . . . 10.0 110.286 162.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.476 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 84.8 Cg_endo -72.21 161.22 45.17 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.36 2.04 . . . . 10.0 110.609 172.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.96 125.08 23.78 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.985 -1.072 . . . . 10.0 109.711 166.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -77.34 74.76 3.9 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 163.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -170.83 0.14 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 10.0 109.503 158.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -32.45 114.44 0.08 OUTLIER Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.13 0.871 . . . . 10.0 112.421 163.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 tp -136.56 -46.79 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.462 1.505 . . . . 10.0 112.054 -174.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.592 ' HB2' HG21 ' A' ' 102' ' ' THR . 2.5 m-85 -71.0 109.58 5.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.434 0.693 . . . . 10.0 109.953 -168.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.25 4.29 90.25 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 118.661 -1.077 . . . . 10.0 113.865 -174.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mtp85 -81.45 -97.28 0.04 OUTLIER 'General case' 0 C--N 1.347 0.478 0 CA-C-O 116.946 -1.502 . . . . 10.0 109.087 169.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -152.42 -119.95 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 120.578 1.536 . . . . 10.0 110.744 174.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.6 m -148.7 165.85 30.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.468 3.107 . . . . 10.0 106.967 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 68.46 -3.58 5.95 Favored Glycine 0 CA--C 1.529 0.917 0 N-CA-C 118.763 2.265 . . . . 10.0 118.763 156.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.23 125.38 26.5 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.603 1.961 . . . . 10.0 111.236 174.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.71 157.38 16.33 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.88 1.672 . . . . 10.0 108.732 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -83.84 -119.24 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 124.005 3.137 . . . . 10.0 109.897 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.99 74.8 0.95 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.915 1.245 . . . . 10.0 113.084 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.476 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 51.0 t80 -144.56 107.24 4.43 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.019 1.327 . . . . 10.0 111.791 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.5 m -79.77 95.32 5.96 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.773 1.229 . . . . 10.0 111.539 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.05 173.19 11.32 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.356 0.872 . . . . 10.0 113.356 169.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.4 p -69.31 -5.05 20.66 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 128.66 2.784 . . . . 10.0 115.616 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 t70 47.42 -169.46 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.384 1.874 . . . . 10.0 114.046 -159.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.23 -42.82 0.1 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.374 3.07 . . . . 10.0 115.307 -166.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -61.29 2.72 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.838 1.255 . . . . 10.0 111.079 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -43.23 55.18 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 127.315 2.246 . . . . 10.0 112.375 168.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -18.22 65.19 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 115.447 1.647 . . . . 10.0 115.447 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.96 -32.29 61.68 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.093 0.86 . . . . 10.0 111.174 170.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.17 28.43 73.68 Favored Glycine 0 CA--C 1.537 1.466 0 N-CA-C 116.277 1.271 . . . . 10.0 116.277 162.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -7.55 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 127.343 2.257 . . . . 10.0 116.584 -173.19 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.4 m 57.62 108.47 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.695 2.398 . . . . 10.0 114.384 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -66.62 135.07 53.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.18 1.392 . . . . 10.0 110.624 172.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 163.23 -72.5 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 129.875 3.27 . . . . 10.0 107.692 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -44.82 -61.77 1.47 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.548 1.939 . . . . 10.0 111.477 -178.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 2.3 p -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 127.611 2.364 . . . . 10.0 112.22 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -32.92 60.23 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.105 0.962 . . . . 10.0 113.449 177.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 6.8 ttm -62.83 -52.9 61.35 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 170.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -64.97 -38.19 90.15 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.226 1.41 . . . . 10.0 111.025 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -60.83 -64.09 1.08 Allowed 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.208 1.003 . . . . 10.0 110.716 170.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.72 -32.15 68.94 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.611 1.096 . . . . 10.0 112.67 -175.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.4 -35.33 69.89 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.669 1.359 . . . . 10.0 114.669 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -162.39 80.49 1.81 Allowed Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 119.811 1.187 . . . . 10.0 111.543 173.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.7 -44.68 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.413 2.076 . . . . 10.0 112.174 -160.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -60.14 -34.78 74.02 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 127.209 2.204 . . . . 10.0 113.359 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -76.3 -41.41 48.71 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 119.061 -0.495 . . . . 10.0 111.489 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -69.88 -39.25 76.4 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.649 1.351 . . . . 10.0 114.649 -171.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 21.0 pt -135.17 144.02 48.25 Favored Pre-proline 0 N--CA 1.473 0.696 0 CA-C-N 118.811 0.732 . . . . 10.0 111.458 172.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -69.3 163.87 36.28 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.192 2.594 . . . . 10.0 111.083 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.15 -22.82 0.16 Allowed Glycine 0 CA--C 1.535 1.323 0 N-CA-C 116.344 1.298 . . . . 10.0 116.344 176.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.73 118.63 5.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 120.053 1.926 . . . . 10.0 109.745 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -87.12 -71.08 0.58 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.871 0.868 . . . . 10.0 110.683 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.4 ttp 28.61 101.17 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 129.892 3.277 . . . . 10.0 113.987 -176.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.6 tp -64.2 54.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 128.871 2.868 . . . . 10.0 114.407 -174.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -163.4 -176.08 4.56 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.542 2.337 . . . . 10.0 110.697 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.51 -155.82 0.34 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.867 2.467 . . . . 10.0 109.763 -173.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.68 44.06 0.15 Allowed Glycine 0 CA--C 1.536 1.354 0 C-N-CA 128.193 2.806 . . . . 10.0 117.656 -170.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.442 HG23 ' H ' ' A' ' 86' ' ' LYS 0.368 7.4 tt 42.96 -112.19 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 128.833 2.853 . . . . 10.0 113.036 -177.45 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.442 ' H ' HG23 ' A' ' 85' ' ' ILE . 53.9 tttm -149.7 -69.65 0.2 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.157 1.799 . . . . 10.0 113.259 173.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.474 ' HE3' ' H ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -76.74 148.04 36.96 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.486 1.039 . . . . 10.0 110.684 173.255 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -58.55 -36.84 74.52 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.11 -0.369 . . . . 10.0 111.619 169.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 m -55.94 -53.81 52.3 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 124.774 1.23 . . . . 10.0 110.062 176.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -57.76 -39.4 77.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.832 0.853 . . . . 10.0 111.771 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -59.2 -50.51 73.76 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 118.764 -0.636 . . . . 10.0 111.709 175.109 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -58.19 -52.63 64.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.392 1.077 . . . . 10.0 111.539 172.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -55.81 -47.78 76.56 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 126.841 2.056 . . . . 10.0 111.465 -170.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.56 -43.8 93.48 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.4 mm -65.45 -44.26 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 118.948 -0.549 . . . . 10.0 110.528 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.38 85.74 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.649 0.779 . . . . 10.0 112.163 175.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.403 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 1.1 t80 -57.21 -55.07 39.54 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.061 1.344 . . . . 10.0 111.443 171.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 22.6 mt -63.29 -34.7 78.25 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 118.436 -0.792 . . . . 10.0 112.618 -177.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -59.98 -20.79 59.54 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.941 1.296 . . . . 10.0 113.462 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -92.87 -50.68 5.44 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.73 1.212 . . . . 10.0 112.196 165.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.04 -22.85 63.17 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 120.21 1.368 . . . . 10.0 114.567 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 36' ' ' PHE . 14.6 t -76.55 6.4 5.89 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.586 1.954 . . . . 10.0 114.489 169.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -151.37 -42.35 0.12 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.855 1.662 . . . . 10.0 113.685 -166.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 115.987 -1.959 . . . . 10.0 115.224 -179.184 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.608 -1.106 . . . . 10.0 113.51 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -118.12 154.5 32.02 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.776 1.63 . . . . 10.0 112.143 166.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.92 -52.15 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.21 1.404 . . . . 10.0 111.886 171.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -47.36 71.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 124.277 1.031 . . . . 10.0 113.469 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.58 -15.66 58.72 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.961 0.8 . . . . 10.0 112.204 172.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.21 -48.96 3.4 Favored Glycine 0 C--N 1.34 0.773 0 C-N-CA 125.224 1.393 . . . . 10.0 112.318 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.416 ' HB3' ' CD1' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -63.88 -35.12 79.6 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 122.264 -0.55 . . . . 10.0 112.478 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -39.18 90.01 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.441 0.904 . . . . 10.0 113.441 174.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -33.89 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.615 1.098 . . . . 10.0 111.079 175.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -55.98 -52.07 65.49 Favored 'General case' 0 C--N 1.342 0.244 0 O-C-N 121.435 -0.791 . . . . 10.0 110.454 167.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.9 t -63.67 -11.41 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 113.632 0.975 . . . . 10.0 113.632 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -85.32 -48.0 9.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.271 1.028 . . . . 10.0 111.337 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -136.07 4.85 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 -168.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.5 m -116.74 -41.6 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.439 1.496 . . . . 10.0 111.215 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.64 -27.07 57.66 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.538 0.94 . . . . 10.0 113.538 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -55.34 -15.21 2.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.882 2.073 . . . . 10.0 115.571 172.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 69.4 m -142.09 -14.32 0.8 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.237 1.415 . . . . 10.0 112.673 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -128.44 -13.45 4.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.845 1.424 . . . . 10.0 114.845 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.3 t 39.46 11.62 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 120.352 3.464 . . . . 10.0 120.352 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.0 p -63.82 -16.02 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 N-CA-C 117.053 2.242 . . . . 10.0 117.053 -160.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.03 6.83 4.71 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.251 1.387 . . . . 10.0 112.443 169.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -152.02 -173.26 4.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.188 2.995 . . . . 10.0 107.941 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.168 0 O-C-N 121.057 -1.027 . . . . 10.0 112.113 179.472 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -134.68 148.46 19.53 Favored Glycine 0 CA--C 1.547 2.065 0 CA-C-N 121.902 2.137 . . . . 10.0 113.724 165.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -82.27 68.08 7.89 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.064 3.176 . . . . 10.0 112.395 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 p30 47.73 -11.46 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.495 1 N-CA-C 122.121 4.119 . . . . 10.0 122.121 157.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . 0.315 5.0 mp 55.28 37.37 28.8 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 128.755 2.822 . . . . 10.0 117.158 -175.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.67 108.22 0.29 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.945 1.698 . . . . 10.0 113.954 164.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.27 35.17 49.42 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 116.187 1.235 . . . . 10.0 116.187 158.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.78 -175.85 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 126.505 1.922 . . . . 10.0 111.696 168.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 60.39 64.97 1.12 Allowed 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.336 -1.478 . . . . 10.0 112.855 -173.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.59 -35.28 2.51 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.591 2.043 . . . . 10.0 112.886 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.544 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -66.79 154.41 40.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.335 1.054 . . . . 10.0 110.488 169.469 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -62.87 177.97 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.875 1.67 . . . . 10.0 111.963 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.71 156.17 31.25 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.12 -0.988 . . . . 10.0 109.731 158.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.44 -116.21 4.35 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.249 -0.907 . . . . 10.0 112.926 169.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 54.64 -7.38 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.268 2.227 . . . . 10.0 116.766 -172.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.42 158.59 10.51 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.327 2.651 . . . . 10.0 113.349 176.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.53 -175.25 1.04 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.144 2.562 . . . . 10.0 111.002 161.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.99 28.36 0.07 OUTLIER Glycine 0 CA--C 1.541 1.688 0 C-N-CA 127.492 2.472 . . . . 10.0 118.015 -173.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.27 128.06 34.16 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.917 1.687 . . . . 10.0 109.707 166.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 m -73.46 125.04 27.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.175 0.99 . . . . 10.0 112.489 -174.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.08 178.15 7.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.536 1.934 . . . . 10.0 112.572 -175.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.0 p -85.93 106.24 16.98 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.169 0.895 . . . . 10.0 110.856 166.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -56.29 -29.49 61.25 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.863 1.801 . . . . 10.0 115.863 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.82 -54.94 31.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.87 1.268 . . . . 10.0 112.094 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -47.27 -55.98 7.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.746 1.618 . . . . 10.0 111.82 174.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.412 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -57.0 -57.25 13.35 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.571 0.748 . . . . 10.0 110.924 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -65.6 -22.74 66.7 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.489 0.922 . . . . 10.0 113.489 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -20.99 66.38 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.135 0.88 . . . . 10.0 112.858 171.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.06 11.58 63.89 Favored Glycine 0 CA--C 1.535 1.336 0 N-CA-C 116.076 1.191 . . . . 10.0 116.076 164.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.28 -6.29 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 128.643 2.777 . . . . 10.0 117.236 -171.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 84.9 m 58.38 117.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.65 2.78 . . . . 10.0 115.665 171.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 21.6 m95 -76.0 120.73 21.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.861 -1.063 . . . . 10.0 112.644 -175.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.37 179.21 5.12 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.262 2.225 . . . . 10.0 110.605 -176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.75 -13.24 62.18 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.248 1.419 . . . . 10.0 114.754 -169.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.02 -58.61 3.18 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.505 1.145 . . . . 10.0 111.406 163.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.6 p -75.19 -37.32 61.25 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.728 1.611 . . . . 10.0 112.882 -165.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.02 -11.71 59.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.965 1.306 . . . . 10.0 113.938 172.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -65.95 0.61 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 106.878 -1.527 . . . . 10.0 106.878 158.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -45.53 70.56 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.431 1.092 . . . . 10.0 111.332 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -66.64 -56.05 12.46 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.463 0.912 . . . . 10.0 113.463 -177.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -27.5 65.62 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.584 1.538 . . . . 10.0 112.36 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -66.55 -38.06 86.31 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 120.197 1.362 . . . . 10.0 114.227 169.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -162.81 100.13 1.06 Allowed Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 119.885 1.221 . . . . 10.0 111.672 166.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.435 ' HB2' HG21 ' A' ' 78' ' ' THR . 58.3 Cg_endo -71.69 -46.48 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.271 1.981 . . . . 10.0 111.493 -168.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -70.03 -22.36 63.1 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.224 1.81 . . . . 10.0 113.293 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -72.44 -53.93 10.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.716 0.806 . . . . 10.0 110.43 163.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -58.99 -41.0 86.54 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.42 155.27 64.28 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 124.228 1.011 . . . . 10.0 111.852 170.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.36 150.6 52.78 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.56 2.173 . . . . 10.0 113.193 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.87 -100.44 2.52 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.089 2.28 . . . . 10.0 111.208 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 71' ' ' PRO 0.289 96.9 m 34.65 90.43 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 130.731 3.612 . . . . 10.0 116.058 -176.075 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -73.31 19.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.853 1.427 . . . . 10.0 114.853 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.5 ttt -70.29 78.16 0.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.158 -0.964 . . . . 10.0 108.932 164.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 25.9 mm -69.51 78.56 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 125.0 1.32 . . . . 10.0 109.654 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -162.73 -72.42 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.52 1.128 . . . . 10.0 111.935 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -70.6 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.268 2.627 . . . . 10.0 116.439 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.17 86.78 0.11 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 126.621 2.058 . . . . 10.0 113.828 -166.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.406 ' CD1' HD22 ' A' ' 94' ' ' LEU . 21.1 tt -63.28 -53.99 38.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 115.108 1.521 . . . . 10.0 115.108 -163.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 163.58 -169.8 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 1 C-N-CA 131.821 4.049 . . . . 10.0 109.138 -175.742 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.435 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.64 -70.21 0.11 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.924 2.489 . . . . 10.0 114.207 -162.615 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.71 -51.5 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.502 1.297 . . . . 10.0 114.502 -173.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -46.87 88.26 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.439 1.018 . . . . 10.0 110.525 -175.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -60.27 -33.71 72.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.937 1.695 . . . . 10.0 112.179 -172.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.9 -43.94 97.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.009 2.124 . . . . 10.0 112.476 172.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.71 -43.44 65.9 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.896 1.278 . . . . 10.0 110.565 174.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -58.24 -44.09 88.13 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.689 1.196 . . . . 10.0 110.376 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.406 HD22 ' CD1' ' A' ' 85' ' ' ILE . 1.0 OUTLIER -52.61 -47.63 66.85 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.229 1.196 . . . . 10.0 114.229 171.567 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.94 -47.22 89.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.62 82.16 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.648 0.779 . . . . 10.0 112.319 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.416 ' CD1' ' HB3' ' A' ' 7' ' ' LYS . 3.6 t80 -65.01 -63.23 1.16 Allowed 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.611 1.164 . . . . 10.0 112.017 171.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.43 -33.27 75.56 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.262 -0.875 . . . . 10.0 112.419 -170.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.55 -14.48 42.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.642 1.177 . . . . 10.0 113.311 172.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -95.29 -58.95 2.0 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.421 1.089 . . . . 10.0 110.952 161.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.81 -16.63 17.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 116.429 2.011 . . . . 10.0 116.429 -168.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.5 p -74.96 -4.54 38.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.844 1.424 . . . . 10.0 114.844 168.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -153.32 -22.24 0.15 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.062 1.745 . . . . 10.0 114.465 -167.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 C--O 1.249 1.035 0 C-N-CA 126.872 2.069 . . . . 10.0 111.059 -160.933 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.667 0 CA-C-O 118.924 -0.931 . . . . 10.0 112.326 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.07 140.93 36.22 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.087 0.944 . . . . 10.0 112.816 -149.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.436 HG11 ' HG3' ' A' ' 100' ' ' LYS . 0.1 OUTLIER -55.35 -50.05 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.837 2.055 . . . . 10.0 113.223 178.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mp0 -64.44 -32.94 74.77 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.373 -0.829 . . . . 10.0 111.639 -174.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -76.02 -12.38 60.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.031 1.732 . . . . 10.0 112.842 172.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.75 -48.01 3.53 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 124.21 0.91 . . . . 10.0 111.269 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -49.98 -44.34 50.79 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.161 0.98 . . . . 10.0 112.831 174.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.432 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -67.26 -12.86 61.21 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.883 1.673 . . . . 10.0 114.328 -177.828 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.432 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 8.1 tp -114.78 -28.03 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.689 0.796 . . . . 10.0 112.204 174.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -55.58 -52.91 62.17 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.224 1.01 . . . . 10.0 110.456 163.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.33 -12.8 9.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.936 0.717 . . . . 10.0 112.936 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.25 -70.23 0.72 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.919 1.288 . . . . 10.0 109.43 172.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -80.48 -11.14 59.71 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.228 1.566 . . . . 10.0 115.228 -168.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 m -124.46 -48.13 1.83 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.649 1.179 . . . . 10.0 111.735 -171.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.31 -13.2 57.94 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.658 0.985 . . . . 10.0 113.658 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -55.35 -14.15 1.74 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.858 1.663 . . . . 10.0 114.143 162.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.3 m -142.74 -25.03 0.63 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.803 2.041 . . . . 10.0 113.134 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.431 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 81.9 m-70 -126.74 77.17 1.7 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 127.145 2.178 . . . . 10.0 112.154 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 t -75.17 46.52 0.32 Allowed 'General case' 0 CA--C 1.557 1.249 0 O-C-N 120.182 -1.574 . . . . 10.0 114.494 -175.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.72 -51.46 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.802 1.641 . . . . 10.0 113.218 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -53.42 -45.26 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.719 1.208 . . . . 10.0 111.52 -171.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -86.17 7.24 25.8 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.63 1.572 . . . . 10.0 113.198 -176.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.08 0 C-N-CA 124.535 1.064 . . . . 10.0 114.521 175.411 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.72 167.36 16.32 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 123.835 0.731 . . . . 10.0 111.904 169.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 45.7 Cg_endo -68.3 166.3 25.81 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.27 3.313 . . . . 10.0 110.921 169.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -85.19 139.97 31.26 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.664 -1.235 . . . . 10.0 107.664 164.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.7 74.8 5.22 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.587 -0.894 . . . . 10.0 108.587 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 73.66 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.557 3.143 . . . . 10.0 113.159 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.27 -68.73 0.06 OUTLIER Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.506 2.479 . . . . 10.0 111.443 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.451 ' C ' HH11 ' A' ' 38' ' ' ARG 0.288 6.9 tp 112.06 -122.79 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.483 1 C-N-CA 132.529 4.331 . . . . 10.0 109.322 167.002 . . . . . . . . 4 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 72.0 m-85 32.72 64.81 0.25 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.731 2.412 . . . . 10.0 116.731 167.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.25 -42.24 1.73 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.915 2.198 . . . . 10.0 115.023 172.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.451 HH11 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -64.62 11.0 0.06 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 120.363 3.468 . . . . 10.0 120.363 -158.567 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.9 mttt 79.03 147.2 0.09 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.527 3.131 . . . . 10.0 113.379 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -71.78 -40.65 69.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.605 1.562 . . . . 10.0 111.949 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.0 56.66 1.43 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 126.223 1.868 . . . . 10.0 113.251 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -129.95 -22.75 2.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 -173.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.18 105.13 0.48 Allowed Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 126.067 1.747 . . . . 10.0 113.538 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -79.97 62.32 8.48 Favored 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.11 3.207 . . . . 10.0 114.085 -163.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.13 60.63 0.18 Allowed Glycine 0 N--CA 1.471 1.027 0 C-N-CA 124.891 1.234 . . . . 10.0 112.341 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -143.63 170.75 15.25 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.545 1.538 . . . . 10.0 109.748 -169.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.6 t -152.84 153.6 33.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 122.08 0.943 . . . . 10.0 110.946 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -155.26 -105.14 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.737 -1.119 . . . . 10.0 110.369 -150.552 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 50.3 p -141.78 9.44 1.97 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.352 1.061 . . . . 10.0 112.859 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 48.95 -50.14 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.553 3.141 . . . . 10.0 115.009 -159.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.47 -41.22 9.24 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.725 2.01 . . . . 10.0 113.192 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -48.57 -60.9 2.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.514 1.526 . . . . 10.0 112.843 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -75.35 -33.7 61.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.171 0.988 . . . . 10.0 112.12 179.082 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.71 -32.8 74.34 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.429 1.092 . . . . 10.0 113.488 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -50.58 73.51 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.898 0.772 . . . . 10.0 110.357 172.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.84 128.54 0.55 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 123.46 0.553 . . . . 10.0 113.59 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.411 HD13 ' CE2' ' A' ' 59' ' ' TRP . 0.9 OUTLIER -170.71 13.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 126.952 2.101 . . . . 10.0 112.375 -162.611 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.6 m 44.92 56.58 5.23 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.303 1.441 . . . . 10.0 114.238 152.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.411 ' CE2' HD13 ' A' ' 57' ' ' ILE . 40.3 m95 -52.43 135.82 32.73 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -163.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 15.2 pttp -177.72 -167.47 0.15 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 130.702 3.601 . . . . 10.0 110.579 -168.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -68.74 32.81 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.301 2.641 . . . . 10.0 116.713 -159.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.21 -57.67 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.392 -1.442 . . . . 10.0 111.784 -169.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.4 p -53.63 -44.54 69.62 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 130.942 3.697 . . . . 10.0 111.479 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.9 mp -65.18 -32.98 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.436 1.016 . . . . 10.0 113.37 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.9 mtm -75.24 -25.99 58.53 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 120.116 1.325 . . . . 10.0 111.84 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -75.52 -47.58 26.3 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 118.929 0.786 . . . . 10.0 111.708 162.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.68 -43.33 89.61 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 114.009 1.114 . . . . 10.0 114.009 -173.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -64.36 -41.35 96.78 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.326 1.421 . . . . 10.0 111.68 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -68.6 -28.76 67.21 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.902 1.075 . . . . 10.0 113.902 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -161.34 86.88 1.66 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.731 1.212 . . . . 10.0 111.276 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.07 -48.17 5.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.355 2.037 . . . . 10.0 113.694 -169.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -69.98 -19.36 63.35 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.177 1.391 . . . . 10.0 113.036 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.38 -47.75 46.97 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.493 1.117 . . . . 10.0 110.191 167.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -71.98 -40.75 68.35 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.643 0.979 . . . . 10.0 113.643 -174.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.0 pt -135.79 126.7 16.98 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.345 1.058 . . . . 10.0 109.324 170.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -70.77 148.84 59.41 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.455 2.103 . . . . 10.0 111.261 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 47.37 66.75 1.76 Allowed Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.066 1.317 . . . . 10.0 113.124 176.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.2 t -123.61 23.27 8.89 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.216 1.406 . . . . 10.0 113.918 -169.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt 47.83 -88.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.181 2.192 . . . . 10.0 113.631 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt 15.21 90.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 131.019 3.728 . . . . 10.0 113.82 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.515 ' H ' HD12 ' A' ' 81' ' ' ILE . 2.6 mp -74.52 54.89 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 126.733 2.013 . . . . 10.0 110.139 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -163.28 66.63 0.19 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.411 1.885 . . . . 10.0 109.709 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.39 112.19 11.45 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.157 0.983 . . . . 10.0 110.408 172.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.26 175.13 32.99 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.766 1.204 . . . . 10.0 113.612 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -143.92 149.47 17.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.317 -1.364 . . . . 10.0 107.317 157.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -66.83 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.277 1.031 . . . . 10.0 113.185 -166.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -77.05 120.99 22.92 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.037 -1.097 . . . . 10.0 108.037 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -63.66 -16.46 61.04 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.073 1.306 . . . . 10.0 113.999 -174.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 m -55.48 -34.94 65.0 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.948 . . . . 10.0 112.421 163.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.19 -38.63 88.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.97 1.308 . . . . 10.0 111.181 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -60.87 -50.71 72.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.626 1.17 . . . . 10.0 110.938 175.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.56 -53.16 61.52 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.459 1.103 . . . . 10.0 111.886 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -56.66 -44.09 81.02 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.315 1.446 . . . . 10.0 110.617 -175.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mp -60.32 -45.65 92.65 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.189 1.181 . . . . 10.0 114.189 175.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mm -61.04 -48.59 88.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.91 73.68 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.76 0.424 . . . . 10.0 111.549 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.402 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.1 t80 -51.46 -59.1 4.62 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.792 1.637 . . . . 10.0 112.754 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.402 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 48.1 mt -68.45 -36.08 78.51 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.224 0.92 . . . . 10.0 112.15 -178.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -32.46 74.02 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.654 0.661 . . . . 10.0 112.302 178.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HG3' HG11 ' A' ' 3' ' ' VAL . 3.0 mmmp? -72.8 -52.6 14.3 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.333 1.453 . . . . 10.0 112.242 165.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.79 -27.98 45.59 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.898 1.444 . . . . 10.0 114.898 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.6 t -76.49 2.78 12.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 115.643 1.719 . . . . 10.0 115.643 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -151.32 -1.84 0.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.026 1.491 . . . . 10.0 115.026 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 127.525 2.33 . . . . 10.0 114.488 175.669 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.179 -0.768 . . . . 10.0 111.179 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.53 135.16 49.96 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.423 0.689 . . . . 10.0 112.645 -155.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.28 -50.61 70.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 125.749 1.62 . . . . 10.0 111.438 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.83 -40.1 87.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.681 1.592 . . . . 10.0 114.084 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.79 -26.48 68.37 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.751 0.82 . . . . 10.0 112.514 169.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.54 -52.02 4.64 Favored Glycine 0 C--N 1.335 0.499 0 N-CA-C 110.281 -1.128 . . . . 10.0 110.281 -178.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.23 38.7 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.769 2.027 . . . . 10.0 114.709 176.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -42.16 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.713 2.405 . . . . 10.0 110.988 175.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 tp -74.83 -33.96 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 119.796 1.18 . . . . 10.0 111.426 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -56.25 -51.12 69.29 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-O 121.25 0.548 . . . . 10.0 109.889 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.7 t -65.19 -9.43 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.543 0.737 . . . . 10.0 112.539 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -94.56 -58.59 2.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.436 1.494 . . . . 10.0 111.038 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -116.99 8.74 13.49 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 116.236 1.939 . . . . 10.0 116.236 -168.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.8 m -118.81 -46.55 2.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.074 1.35 . . . . 10.0 110.842 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.02 62.58 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.05 1.13 . . . . 10.0 114.05 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.28 -12.12 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.757 1.223 . . . . 10.0 114.146 165.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.8 m -143.22 -17.57 0.65 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.083 1.753 . . . . 10.0 114.091 -176.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -132.51 102.07 5.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.699 2.0 . . . . 10.0 112.731 -175.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -67.15 24.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 128.988 2.915 . . . . 10.0 116.943 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.8 p -64.58 -39.33 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 120.404 -1.435 . . . . 10.0 114.483 -168.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -59.9 -14.45 15.53 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.011 1.724 . . . . 10.0 115.064 -160.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -150.31 13.05 0.75 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.1 2.16 . . . . 10.0 110.83 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.382 0 C-N-CA 125.74 1.638 . . . . 10.0 113.92 -168.309 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.1 m . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.977 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.69 -174.28 25.82 Favored Glycine 0 CA--C 1.541 1.71 0 N-CA-C 110.402 -1.079 . . . . 10.0 110.402 150.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -65.92 173.83 6.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.639 2.226 . . . . 10.0 110.267 168.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.532 HD21 ' CD2' ' A' ' 33' ' ' HIS . 13.7 p30 -74.01 0.71 12.8 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.391 1.477 . . . . 10.0 112.87 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.47 28.23 15.16 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.429 2.292 . . . . 10.0 114.77 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.532 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -53.74 157.42 2.31 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.826 1.25 . . . . 10.0 112.613 168.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.23 8.69 3.62 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 127.821 2.629 . . . . 10.0 118.787 149.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.436 ' CD2' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -73.17 -173.86 1.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.603 1.702 . . . . 10.0 114.001 -177.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 60.58 48.39 7.47 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.813 1.645 . . . . 10.0 110.367 -152.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 146.06 -17.38 1.74 Allowed Glycine 0 CA--C 1.545 1.927 0 N-CA-C 117.921 1.928 . . . . 10.0 117.921 176.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.436 ' NH1' ' CD2' ' A' ' 35' ' ' LEU . 16.2 ttp180 -63.58 3.92 0.3 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.708 2.484 . . . . 10.0 117.708 -165.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.279 0.0 OUTLIER 70.58 -0.76 2.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.944 2.497 . . . . 10.0 116.615 -170.185 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.293 13.8 t 52.47 -43.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 129.585 3.154 . . . . 10.0 116.217 -165.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.85 76.23 0.01 OUTLIER Glycine 0 CA--C 1.534 1.221 0 C-N-CA 126.468 1.985 . . . . 10.0 112.828 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -168.1 123.0 0.97 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.327 2.251 . . . . 10.0 111.203 -175.454 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.92 119.02 0.97 Allowed Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.149 1.379 . . . . 10.0 109.394 169.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 69.5 2.9 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.678 2.919 . . . . 10.0 112.134 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.12 75.59 1.25 Allowed Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.215 1.864 . . . . 10.0 112.962 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -146.56 179.88 7.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.442 1.497 . . . . 10.0 109.658 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 94.2 m -154.79 88.76 1.2 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.737 1.215 . . . . 10.0 108.838 171.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.485 1.514 . . . . 10.0 110.87 169.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 52.4 p -75.19 71.46 2.22 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.149 0.98 . . . . 10.0 110.909 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -55.97 -12.87 1.57 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.215 2.206 . . . . 10.0 116.112 -161.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.33 -26.65 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.452 -1.405 . . . . 10.0 113.141 165.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.476 ' HB2' HD12 ' A' ' 75' ' ' ILE . 17.2 p30 -78.14 -67.86 0.69 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.345 1.979 . . . . 10.0 116.345 159.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.51 -39.27 48.15 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.134 1.333 . . . . 10.0 113.248 -174.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -19.99 65.5 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.445 1.498 . . . . 10.0 114.043 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -66.92 -27.34 67.41 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.928 1.695 . . . . 10.0 111.648 168.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.79 12.13 64.1 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 115.619 1.007 . . . . 10.0 115.619 168.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -53.82 -10.17 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 127.655 2.382 . . . . 10.0 115.882 -174.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 88.8 m 57.38 128.61 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 130.122 3.369 . . . . 10.0 115.511 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -75.76 145.8 40.51 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.18 -0.918 . . . . 10.0 112.973 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 175.33 175.18 0.23 Allowed 'General case' 0 CA--C 1.538 0.487 1 C-N-CA 133.33 4.652 . . . . 10.0 106.035 -179.421 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.79 -30.39 22.83 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.517 1.302 . . . . 10.0 114.517 177.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -75.43 5.65 5.54 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.978 2.214 . . . . 10.0 116.978 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.2 p -160.53 -31.07 0.06 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.968 1.307 . . . . 10.0 111.706 -171.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 -19.67 58.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.5 1.046 . . . . 10.0 112.468 171.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -60.82 3.19 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 162.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -53.4 -45.71 69.41 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 127.741 2.416 . . . . 10.0 110.124 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CE1' HD11 ' A' ' 75' ' ' ILE . 70.6 t80 -73.47 -46.91 45.34 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 117.867 -1.063 . . . . 10.0 113.371 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.24 -39.78 95.6 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.969 1.713 . . . . 10.0 111.699 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -65.16 -32.5 74.22 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.578 1.081 . . . . 10.0 113.411 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.15 77.05 1.82 Allowed Pre-proline 0 CA--C 1.558 1.271 0 CA-C-N 119.858 1.208 . . . . 10.0 111.802 -175.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.14 -54.81 0.35 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.112 1.875 . . . . 10.0 112.905 -160.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -64.58 -23.03 67.13 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.322 1.849 . . . . 10.0 113.596 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -77.21 -47.44 20.22 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.622 1.169 . . . . 10.0 111.758 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.89 -45.0 94.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 178.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 52' ' ' ASN . 6.1 pt -136.65 145.94 53.32 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.838 0.855 . . . . 10.0 111.697 176.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.76 161.04 40.04 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 122.994 2.463 . . . . 10.0 113.266 -168.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.22 -25.16 0.26 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 126.328 1.918 . . . . 10.0 116.84 171.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.8 m -36.68 115.63 0.38 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.18 2.592 . . . . 10.0 114.674 -165.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -86.44 6.66 29.26 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.088 1.514 . . . . 10.0 115.088 177.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.4 ttt -60.4 92.13 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.625 -0.672 . . . . 10.0 109.416 158.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.2 tt -68.06 -17.84 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 122.7 1.238 . . . . 10.0 113.656 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -75.28 78.45 2.38 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.366 2.266 . . . . 10.0 110.728 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.08 59.79 0.18 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.786 1.634 . . . . 10.0 113.193 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.9 -166.12 29.8 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.456 1.503 . . . . 10.0 113.955 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -142.07 155.64 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.951 1.301 . . . . 10.0 109.439 -171.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -67.37 -78.4 0.06 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.158 1.783 . . . . 10.0 113.793 -153.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -76.43 106.75 8.24 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.51 -12.09 2.45 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 116.556 2.058 . . . . 10.0 116.556 -167.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 m -57.68 -40.28 79.05 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.269 1.428 . . . . 10.0 112.798 161.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.88 -35.27 66.32 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.458 1.503 . . . . 10.0 110.863 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.84 2.58 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.59 1.956 . . . . 10.0 114.312 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.491 ' HA ' ' H ' ' A' ' 95' ' ' ILE . 7.3 pt-20 -157.18 -5.4 0.1 Allowed 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.043 1.337 . . . . 10.0 113.5 -174.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -57.21 -47.67 80.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 140.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.58 -49.47 72.64 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.71 1.604 . . . . 10.0 114.577 170.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.491 ' H ' ' HA ' ' A' ' 92' ' ' GLU . 11.2 mm -60.0 -46.43 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.54 83.83 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.184 0.994 . . . . 10.0 112.423 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -58.7 7.39 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.657 1.183 . . . . 10.0 112.083 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.88 -31.6 72.63 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.038 0.836 . . . . 10.0 112.799 -174.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -64.29 -17.98 64.15 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.483 0.92 . . . . 10.0 113.483 173.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -92.32 -56.17 3.14 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.568 -1.206 . . . . 10.0 110.273 163.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.12 32.96 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.58 1.696 . . . . 10.0 115.58 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.4 t -68.21 -19.01 64.73 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.692 1.368 . . . . 10.0 114.692 168.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.34 -0.78 0.23 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 116.467 2.025 . . . . 10.0 116.467 -166.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 126.8 2.04 . . . . 10.0 110.611 -171.28 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 110.429 -1.068 . . . . 10.0 110.429 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.96 148.01 44.67 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.327 1.851 . . . . 10.0 112.676 -171.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.03 -38.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 121.625 -0.672 . . . . 10.0 111.581 172.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 4.7 mp0 -57.16 -44.67 83.68 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.1 1.148 . . . . 10.0 114.1 173.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -63.84 -33.47 75.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 117.86 0.3 . . . . 10.0 110.639 173.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.03 -41.68 31.64 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.302 1.429 . . . . 10.0 111.178 -172.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' A' ' 4' ' ' GLU . 30.7 pttt -69.21 -36.17 76.97 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 118.297 1.049 . . . . 10.0 111.96 174.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.81 -55.91 28.35 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.637 0.775 . . . . 10.0 111.351 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.537 HG13 HD11 ' A' ' 85' ' ' ILE . 9.8 tp -64.56 -33.24 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.576 0.626 . . . . 10.0 112.564 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 39.1 t80 -57.65 -52.5 65.17 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 119.126 0.876 . . . . 10.0 110.459 169.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -62.21 -13.3 9.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -97.29 -36.16 10.49 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.494 1.518 . . . . 10.0 112.785 -175.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -137.01 3.63 2.68 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 116.373 1.99 . . . . 10.0 116.373 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.401 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.7 m -122.77 -43.02 2.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.208 1.403 . . . . 10.0 111.839 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.5 4.9 2.06 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.667 1.358 . . . . 10.0 114.667 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -38.46 14.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.511 1.524 . . . . 10.0 111.932 172.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 m -88.61 -38.04 15.15 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.487 2.315 . . . . 10.0 113.751 168.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.425 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.6 m-70 -114.66 -172.59 2.14 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 129.137 2.975 . . . . 10.0 111.917 -175.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.4 m -166.41 153.1 9.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.68 1.992 . . . . 10.0 108.163 157.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.8 p -156.65 -35.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 113.562 0.949 . . . . 10.0 113.562 169.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -60.33 -4.13 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 130.675 3.59 . . . . 10.0 115.96 -168.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -151.17 7.35 0.52 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.68 2.792 . . . . 10.0 111.662 -170.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.36 0 C-N-CA 125.536 1.541 . . . . 10.0 111.943 -161.081 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 118.916 -0.564 . . . . 10.0 111.852 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.425 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -128.18 172.57 19.16 Favored Glycine 0 CA--C 1.544 1.887 0 C-N-CA 124.488 1.042 . . . . 10.0 110.964 150.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.21 166.02 22.51 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 124.392 3.395 . . . . 10.0 112.416 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.98 137.67 57.88 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.07 -1.019 . . . . 10.0 109.196 159.578 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.83 60.98 2.38 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.349 1.431 . . . . 10.0 111.981 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.18 87.65 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 130.263 3.425 . . . . 10.0 113.568 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.36 43.04 65.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.953 1.74 . . . . 10.0 114.663 169.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -72.4 149.6 44.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 117.849 0.825 . . . . 10.0 110.577 173.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 75.52 76.41 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.017 2.527 . . . . 10.0 111.609 -161.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.54 29.97 0.23 Allowed Glycine 0 CA--C 1.536 1.361 0 N-CA-C 117.353 1.701 . . . . 10.0 117.353 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.477 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 13.0 ptt85 -152.53 -84.17 0.08 Allowed 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 120.748 2.274 . . . . 10.0 115.787 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 16.7 pttp -168.28 -176.38 2.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.697 2.799 . . . . 10.0 109.943 -177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -67.15 -132.72 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.718 2.007 . . . . 10.0 111.873 162.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -18.17 115.96 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 1 C-N-CA 130.708 4.004 . . . . 10.0 117.809 -178.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -152.23 3.52 0.37 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 117.971 2.582 . . . . 10.0 117.971 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 155.0 88.64 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 121.299 1.863 . . . . 10.0 111.874 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.29 74.04 3.16 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.243 2.628 . . . . 10.0 109.637 170.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.48 -73.22 1.63 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.03 1.3 . . . . 10.0 111.624 -170.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 t80 43.6 -143.73 0.12 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.632 1.173 . . . . 10.0 110.102 -164.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.8 m -164.5 108.76 0.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.809 2.044 . . . . 10.0 108.096 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -152.8 176.53 11.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.151 1.38 . . . . 10.0 112.211 -172.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.4 p -80.35 109.78 15.17 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.021 0.915 . . . . 10.0 111.99 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -55.05 -22.41 15.79 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.743 0.817 . . . . 10.0 112.821 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -48.72 -43.04 36.98 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.495 1.118 . . . . 10.0 113.445 170.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.416 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 49.9 t-20 -76.58 -38.81 54.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.751 1.221 . . . . 10.0 112.673 172.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 52' ' ' ASN . 6.8 mmpt? -74.93 -52.11 12.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.819 0.847 . . . . 10.0 110.827 -172.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.97 -21.04 66.39 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.62 1.568 . . . . 10.0 113.466 173.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -28.84 62.85 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.426 1.012 . . . . 10.0 112.815 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.04 4.46 72.48 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 123.878 0.751 . . . . 10.0 114.907 168.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 pp -61.26 178.23 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 10.0 111.313 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.0 m -148.77 108.81 4.08 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 123.256 1.503 . . . . 10.0 111.195 -163.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -54.48 116.37 2.62 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.708 2.003 . . . . 10.0 109.24 169.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 -44.98 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.187 1.395 . . . . 10.0 113.07 -168.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -170.03 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.683 1.993 . . . . 10.0 107.32 162.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -47.34 -54.85 10.04 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.353 2.661 . . . . 10.0 112.399 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -52.72 60.83 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 128.371 2.668 . . . . 10.0 111.962 -176.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.06 -28.34 61.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.919 0.888 . . . . 10.0 112.302 -177.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.87 -55.08 33.47 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.562 0.745 . . . . 10.0 109.957 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.54 -43.79 98.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.458 1.103 . . . . 10.0 110.433 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.8 t80 -66.41 -46.58 76.09 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.038 0.935 . . . . 10.0 112.053 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 -37.25 83.23 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.77 1.623 . . . . 10.0 112.698 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.64 -36.76 84.89 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.036 -0.983 . . . . 10.0 113.063 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -163.45 106.19 0.97 Allowed Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 119.685 1.129 . . . . 10.0 111.873 160.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.43 -48.76 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.481 2.121 . . . . 10.0 110.685 -171.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -37.9 77.2 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.177 1.391 . . . . 10.0 112.475 179.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -61.6 -54.54 41.57 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.69 1.196 . . . . 10.0 110.63 168.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -64.43 -45.25 88.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.918 1.081 . . . . 10.0 113.918 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 pt -136.0 95.45 13.62 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 123.992 0.917 . . . . 10.0 110.548 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.01 76.69 2.05 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 125.035 3.824 . . . . 10.0 113.84 -163.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.51 -25.5 0.03 OUTLIER Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.222 1.868 . . . . 10.0 112.061 165.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.3 t -40.02 116.91 0.7 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.864 2.066 . . . . 10.0 113.975 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -83.18 16.0 2.62 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.148 0.795 . . . . 10.0 113.148 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.8 ttt -67.16 79.1 0.14 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.845 1.307 . . . . 10.0 111.344 171.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tp -72.99 87.07 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 125.307 1.443 . . . . 10.0 111.714 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -161.49 -51.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.01 -0.995 . . . . 10.0 113.547 175.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.02 92.96 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.137 2.175 . . . . 10.0 115.871 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.22 -178.86 36.05 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.638 1.113 . . . . 10.0 111.436 -169.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.537 HD11 HG13 ' A' ' 9' ' ' ILE . 13.5 tt -155.55 82.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.201 1.0 . . . . 10.0 110.35 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 59.78 -54.18 0.07 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 128.065 2.546 . . . . 10.0 116.157 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.24 166.53 25.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.021 2.529 . . . . 10.0 110.417 -174.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -53.95 -46.23 71.51 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.189 0.995 . . . . 10.0 113.083 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.1 m -68.34 -34.32 75.88 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.669 -0.644 . . . . 10.0 111.896 -175.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -76.86 -10.5 59.41 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.372 1.069 . . . . 10.0 113.445 171.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -35.22 35.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.098 -1.626 . . . . 10.0 114.436 155.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -62.33 -57.14 12.45 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.153 -0.967 . . . . 10.0 111.333 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 58.5 p30 -54.92 -40.65 70.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.725 1.21 . . . . 10.0 112.804 -175.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 85' ' ' ILE . 14.9 tp -60.94 -53.88 51.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.912 2.485 . . . . 10.0 112.996 177.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.02 -44.92 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.185 0.994 . . . . 10.0 108.872 174.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.02 -49.97 75.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.661 0.385 . . . . 10.0 111.369 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.8 -61.75 2.1 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.267 1.427 . . . . 10.0 112.068 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.2 mt -59.65 -38.12 80.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.66 1.118 . . . . 10.0 111.815 -176.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -64.76 -24.45 67.56 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.277 1.031 . . . . 10.0 113.596 176.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.512 ' HA ' ' HE2' ' A' ' 100' ' ' LYS . 8.5 mmpt? -87.37 -40.33 14.52 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.847 -1.073 . . . . 10.0 112.239 166.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.68 -22.76 65.6 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.379 1.251 . . . . 10.0 114.379 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t -85.73 9.35 16.67 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 169.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -151.58 21.09 0.72 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.454 2.302 . . . . 10.0 111.88 -166.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.817 1.647 . . . . 10.0 111.217 -174.904 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -81.99 -177.81 6.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.282 0.633 . . . . 10.0 109.493 160.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.03 -34.14 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 120.672 -1.268 . . . . 10.0 111.041 145.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -71.55 -38.75 70.96 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 127.937 2.495 . . . . 10.0 113.557 -157.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.413 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 3.6 mmpt? -63.6 -31.33 72.47 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 173.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.19 -54.04 9.65 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 127.254 2.359 . . . . 10.0 110.29 -173.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -44.91 85.4 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.098 0.777 . . . . 10.0 113.098 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -26.97 60.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.93 1.455 . . . . 10.0 114.93 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -81.39 -32.49 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.669 1.577 . . . . 10.0 111.67 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.41 -51.33 69.87 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 121.677 -0.639 . . . . 10.0 110.219 170.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.99 -12.01 8.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -83.54 -61.3 1.87 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.232 1.013 . . . . 10.0 110.855 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -102.64 -38.25 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.599 1.16 . . . . 10.0 112.457 -170.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.7 m -83.08 -55.17 4.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.128 1.371 . . . . 10.0 111.902 -172.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.61 -15.74 42.03 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -172.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -59.6 -54.52 45.47 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 129.378 3.071 . . . . 10.0 111.898 167.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.8 m -87.5 -21.22 25.61 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.117 1.525 . . . . 10.0 115.117 169.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -134.7 57.64 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.966 1.706 . . . . 10.0 111.991 -167.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.83 120.29 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.72 -1.238 . . . . 10.0 110.827 -174.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.48 -58.39 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 127.068 2.147 . . . . 10.0 108.792 -177.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 -62.31 9.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.187 2.995 . . . . 10.0 114.376 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -151.86 17.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.16 1.784 . . . . 10.0 112.75 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.287 0 C-N-CA 125.847 1.689 . . . . 10.0 111.444 -175.702 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 114.144 1.165 . . . . 10.0 114.144 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.5 166.81 12.44 Favored Glycine 0 CA--C 1.543 1.826 0 CA-C-N 120.191 1.36 . . . . 10.0 113.7 169.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.79 173.58 14.18 Favored 'Trans proline' 0 CA--C 1.541 0.836 1 C-N-CA 125.326 4.017 . . . . 10.0 111.097 167.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.511 HD21 ' CD2' ' A' ' 33' ' ' HIS . 5.9 p30 -77.58 -172.48 2.58 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.222 -0.924 . . . . 10.0 108.745 158.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.1 mt -139.37 51.98 1.75 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 122.798 1.285 . . . . 10.0 111.866 -175.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.511 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -54.22 134.78 44.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.866 2.866 . . . . 10.0 113.165 162.13 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 54.0 8.38 1.01 Allowed Glycine 0 CA--C 1.54 1.616 0 N-CA-C 118.883 2.313 . . . . 10.0 118.883 160.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -51.55 167.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.784 1.634 . . . . 10.0 111.027 170.023 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 61.99 36.31 15.64 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.765 1.226 . . . . 10.0 112.554 -169.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 168.4 -42.82 0.23 Allowed Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.565 1.555 . . . . 10.0 110.894 -175.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 41.6 mtp85 -80.81 159.65 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 122.442 1.115 . . . . 10.0 112.067 167.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -70.71 173.91 6.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.682 1.993 . . . . 10.0 110.998 168.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -67.74 168.76 10.77 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.327 1.851 . . . . 10.0 111.334 157.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 53' ' ' LYS . . . 94.08 14.69 51.01 Favored Glycine 0 N--CA 1.471 0.998 0 N-CA-C 117.657 1.823 . . . . 10.0 117.657 160.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.86 -40.52 11.14 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.952 2.101 . . . . 10.0 115.269 -158.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.63 111.17 2.81 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.13 1.372 . . . . 10.0 114.228 -164.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 131.01 18.79 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.417 2.078 . . . . 10.0 112.129 -174.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.01 1.8 69.49 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.91 0.724 . . . . 10.0 114.91 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -73.2 179.27 3.96 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 118.433 1.117 . . . . 10.0 111.052 167.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 98.7 m -154.18 89.02 1.26 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 119.517 -1.99 . . . . 10.0 109.631 176.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.35 173.61 10.8 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 128.508 2.723 . . . . 10.0 112.277 172.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.8 p -71.21 143.87 50.31 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.423 -0.798 . . . . 10.0 110.508 163.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -76.23 65.14 2.13 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.648 -1.283 . . . . 10.0 111.154 166.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.96 -59.35 0.6 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.203 1.001 . . . . 10.0 110.474 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -54.88 -70.1 0.11 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.919 1.687 . . . . 10.0 111.231 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HB3' ' HA2' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -63.68 -13.13 40.07 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 130.566 3.547 . . . . 10.0 115.309 171.067 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.29 -56.27 7.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.178 -0.951 . . . . 10.0 111.485 160.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -56.3 -27.95 57.2 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.385 1.874 . . . . 10.0 115.448 -170.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.97 7.09 61.54 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.967 1.147 . . . . 10.0 115.967 168.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -56.93 5.96 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 129.463 3.105 . . . . 10.0 117.155 -171.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.6 m 50.59 87.8 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.39 2.676 . . . . 10.0 113.627 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -54.45 125.17 18.48 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.601 2.361 . . . . 10.0 114.987 -171.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -164.66 179.17 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.386 2.674 . . . . 10.0 109.343 -173.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -58.01 -39.3 77.96 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.173 -0.954 . . . . 10.0 112.784 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.89 10.28 0.22 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.444 1.898 . . . . 10.0 115.251 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.2 p -158.21 -33.13 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.757 1.223 . . . . 10.0 111.464 -166.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.13 -29.35 63.98 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 120.469 1.486 . . . . 10.0 112.508 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 73.9 mtm -71.52 -40.1 70.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.251 0.932 . . . . 10.0 111.844 175.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -50.48 72.02 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 167.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.5 -44.73 86.12 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 113.361 0.874 . . . . 10.0 113.361 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.548 ' HB2' HH11 ' A' ' 91' ' ' ARG . 2.7 mm? -73.38 -22.59 60.23 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 121.047 1.749 . . . . 10.0 113.715 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -85.75 -23.85 27.13 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.26 1.208 . . . . 10.0 114.26 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.64 65.56 1.97 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.942 1.297 . . . . 10.0 111.445 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -62.05 -51.55 3.61 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.993 2.462 . . . . 10.0 113.267 -164.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -70.72 -20.8 62.62 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.165 1.786 . . . . 10.0 112.734 -173.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -76.28 -54.39 6.85 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.376 1.47 . . . . 10.0 111.148 163.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -56.87 -45.8 82.24 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.191 0.597 . . . . 10.0 112.335 -175.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.2 pt -133.44 111.91 12.83 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.632 1.173 . . . . 10.0 109.663 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.91 161.11 40.91 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.789 1.66 . . . . 10.0 110.306 175.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.36 5.8 82.58 Favored Glycine 0 CA--C 1.536 1.373 0 CA-C-O 118.648 -1.085 . . . . 10.0 114.769 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m -93.79 122.22 36.04 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.526 1.663 . . . . 10.0 110.769 165.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.26 -10.19 55.05 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.598 1.332 . . . . 10.0 114.598 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttt -21.65 97.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.855 2.862 . . . . 10.0 114.853 -172.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.8 mp -80.09 69.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 125.652 1.581 . . . . 10.0 109.93 -172.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -164.23 -37.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.069 1.747 . . . . 10.0 111.662 170.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.31 -8.7 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 120.8 3.63 . . . . 10.0 120.8 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.09 118.94 0.75 Allowed Glycine 0 CA--C 1.53 1.003 0 CA-C-N 121.185 1.812 . . . . 10.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.0 tt -66.78 -1.71 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 115.332 1.604 . . . . 10.0 115.332 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.0 tttt 70.34 178.01 0.26 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.09 1.756 . . . . 10.0 111.302 -177.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.42 ' HE2' ' OE2' ' A' ' 90' ' ' GLU . 17.8 mtmm 34.26 -105.3 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 127.435 2.294 . . . . 10.0 112.931 -172.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -178.86 -42.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 CA-C-N 120.449 1.477 . . . . 10.0 114.036 171.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.1 m -54.06 -34.63 60.58 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.604 1.162 . . . . 10.0 111.785 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.42 ' OE2' ' HE2' ' A' ' 87' ' ' LYS . 50.2 mp0 -51.75 -41.5 61.64 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.205 2.202 . . . . 10.0 111.891 172.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.548 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -69.17 -49.0 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.357 1.463 . . . . 10.0 110.829 -178.496 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -68.39 -32.97 73.41 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.533 1.06 . . . . 10.0 112.503 175.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -44.67 96.7 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.37 -0.832 . . . . 10.0 111.439 169.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp -58.53 -35.79 72.85 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.023 1.119 . . . . 10.0 114.023 171.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.51 -53.14 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.88 0.764 . . . . 10.0 109.17 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -49.42 77.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.871 0.468 . . . . 10.0 111.72 178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.22 -50.88 68.28 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.148 1.379 . . . . 10.0 112.662 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.78 -32.56 65.69 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.861 1.664 . . . . 10.0 112.31 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.07 -38.83 80.36 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.132 0.878 . . . . 10.0 111.618 170.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -65.41 -70.91 0.21 Allowed 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 117.282 -1.342 . . . . 10.0 111.635 163.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.41 -17.57 13.54 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 116.146 1.906 . . . . 10.0 116.146 -166.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 28.4 p -76.23 -0.45 22.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.437 1.495 . . . . 10.0 114.131 167.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.52 -19.89 0.17 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.925 2.49 . . . . 10.0 114.944 -178.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.227 2.611 . . . . 10.0 110.901 -171.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.77 0 CA-C-O 119.03 -0.872 . . . . 10.0 111.696 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -129.98 147.33 51.72 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.524 0.935 . . . . 10.0 113.524 -150.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.1 -53.77 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.324 1.45 . . . . 10.0 111.615 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.02 -50.2 74.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.893 1.677 . . . . 10.0 113.496 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.96 -37.08 42.3 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 124.099 0.96 . . . . 10.0 112.082 167.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.28 -52.93 8.1 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.619 -1.392 . . . . 10.0 109.619 -174.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -58.09 -47.12 84.18 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 118.974 1.387 . . . . 10.0 112.31 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -27.0 65.26 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 tp -90.65 -28.82 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.58 1.082 . . . . 10.0 112.551 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.48 -53.02 62.41 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.597 0.759 . . . . 10.0 109.771 166.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.43 -10.63 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -84.99 -57.68 3.0 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.723 1.209 . . . . 10.0 110.895 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -130.41 13.22 5.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.268 1.581 . . . . 10.0 115.268 -168.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.1 m -120.57 -45.29 2.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.906 1.283 . . . . 10.0 111.548 170.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.42 -28.79 70.04 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 114.201 1.186 . . . . 10.0 114.201 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -4.25 3.22 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.709 1.604 . . . . 10.0 114.282 171.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -143.56 6.69 1.46 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.168 2.187 . . . . 10.0 112.69 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -158.47 102.28 1.72 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.746 1.619 . . . . 10.0 108.903 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 p -52.6 -47.83 66.67 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.087 1.884 . . . . 10.0 116.087 -169.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.411 HG22 ' HB2' ' A' ' 32' ' ' LEU . 5.6 t 34.12 -82.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 130.134 3.374 . . . . 10.0 115.857 170.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.27 2.22 0.89 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.081 2.152 . . . . 10.0 113.272 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -151.16 134.31 15.99 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 128.839 2.856 . . . . 10.0 107.87 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.063 0 C-N-CA 123.993 0.806 . . . . 10.0 113.574 -172.642 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 117.203 2.298 . . . . 10.0 117.203 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.68 148.76 20.03 Favored Glycine 0 CA--C 1.538 1.496 0 CA-C-N 120.97 1.713 . . . . 10.0 111.787 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -78.34 61.71 7.92 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.019 3.146 . . . . 10.0 114.801 -160.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 49.11 0.81 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 120.536 3.532 . . . . 10.0 120.536 165.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.411 ' HB2' HG22 ' A' ' 20' ' ' VAL . 1.5 mm? 42.56 60.41 2.4 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.592 1.957 . . . . 10.0 110.798 -171.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.79 168.51 0.28 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.92 -1.036 . . . . 10.0 109.678 157.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -23.27 110.57 0.01 OUTLIER Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.645 1.593 . . . . 10.0 113.519 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.95 -74.59 0.61 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.799 1.24 . . . . 10.0 110.036 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -64.88 84.99 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.506 1.922 . . . . 10.0 111.34 -171.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.71 -4.42 2.45 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.756 1.645 . . . . 10.0 114.696 -172.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -152.74 -172.23 4.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.365 1.466 . . . . 10.0 111.2 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -85.62 -173.71 4.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -175.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -60.78 -151.84 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.004 1.722 . . . . 10.0 111.992 158.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 95.07 -67.33 1.23 Allowed Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.662 -1.899 . . . . 10.0 116.314 167.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -69.25 25.33 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 118.954 2.946 . . . . 10.0 118.954 -152.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.24 113.59 8.41 Favored Pre-proline 0 CA--C 1.554 1.109 0 CA-C-N 121.562 1.983 . . . . 10.0 112.755 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.56 70.78 6.73 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.34 2.693 . . . . 10.0 112.832 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.86 69.76 1.16 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.556 1.074 . . . . 10.0 112.874 172.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -151.74 176.65 11.19 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.064 1.746 . . . . 10.0 109.04 174.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -152.19 115.6 4.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.908 2.083 . . . . 10.0 107.885 -165.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -61.23 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.195 1.398 . . . . 10.0 111.103 -161.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.7 t -162.57 165.73 25.6 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 128.802 2.841 . . . . 10.0 108.874 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.08 -67.5 0.6 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.597 1.159 . . . . 10.0 110.741 157.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.21 -65.07 0.21 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 129.111 2.965 . . . . 10.0 115.333 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -51.87 -70.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.07 0.85 . . . . 10.0 111.57 -176.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -74.46 -16.6 60.85 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.853 -165.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.85 -57.66 7.4 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.852 1.261 . . . . 10.0 113.775 157.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -14.93 48.02 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 115.673 1.731 . . . . 10.0 115.673 -163.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.55 11.06 85.66 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 117.915 1.926 . . . . 10.0 117.915 151.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.72 156.16 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 119.819 1.81 . . . . 10.0 113.458 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 m -68.02 108.87 3.24 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.46 1.504 . . . . 10.0 110.716 176.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.76 112.38 13.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.82 -0.55 . . . . 10.0 111.555 172.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -162.17 -162.57 0.84 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.03 1.332 . . . . 10.0 109.695 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' HD12 ' A' ' 95' ' ' ILE . 40.3 tt0 -41.84 -66.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 131.091 3.756 . . . . 10.0 113.21 -174.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -58.36 -54.62 44.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.247 1.419 . . . . 10.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 78.7 p -67.84 -35.9 79.39 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.039 0.936 . . . . 10.0 112.973 -173.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.18 -27.51 59.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 119.832 1.196 . . . . 10.0 113.504 173.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 69.6 mtm -65.91 -52.13 52.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 119.446 1.021 . . . . 10.0 109.406 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.9 -44.38 91.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.136 0.493 . . . . 10.0 110.477 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -63.89 -55.72 20.63 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -75.22 -10.78 59.78 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 121.066 1.757 . . . . 10.0 113.348 -177.729 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -85.37 -25.42 27.08 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.798 1.181 . . . . 10.0 113.978 167.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -162.33 98.37 1.14 Allowed Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.618 1.099 . . . . 10.0 112.974 157.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.35 -47.68 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.765 1.643 . . . . 10.0 112.042 -167.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -64.89 -32.01 73.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.456 1.502 . . . . 10.0 113.027 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -75.78 -39.13 57.53 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-O 118.108 -0.949 . . . . 10.0 112.728 168.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -68.8 -40.18 79.72 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.517 0.932 . . . . 10.0 113.517 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.02 135.25 25.53 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.803 0.841 . . . . 10.0 110.998 174.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -80.18 50.54 3.57 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.088 3.192 . . . . 10.0 114.544 -157.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.48 61.77 0.01 OUTLIER Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.422 -0.799 . . . . 10.0 114.637 172.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -80.1 -30.16 39.13 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.463 1.283 . . . . 10.0 114.463 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 -22.28 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 117.001 2.223 . . . . 10.0 117.001 -166.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.9 ttt -34.76 100.52 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 129.071 2.948 . . . . 10.0 113.803 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 28.5 mt -76.41 71.74 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 125.879 1.672 . . . . 10.0 109.644 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -163.51 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.254 1.022 . . . . 10.0 113.236 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.78 -15.13 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 120.26 3.43 . . . . 10.0 120.26 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.67 158.52 28.69 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-N 121.695 2.043 . . . . 10.0 113.498 172.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.468 HG23 ' H ' ' A' ' 86' ' ' LYS . 16.3 tt -78.96 -79.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.111 1.523 . . . . 10.0 115.111 -169.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.468 ' H ' HG23 ' A' ' 85' ' ' ILE . 20.6 mtpt -156.9 -52.76 0.08 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.024 1.73 . . . . 10.0 111.635 -169.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -162.99 161.41 25.53 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 129.627 3.171 . . . . 10.0 107.306 174.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -57.26 -46.66 82.84 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.998 0.74 . . . . 10.0 112.998 -168.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . 0.266 83.5 m -64.56 -26.61 68.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.368 1.248 . . . . 10.0 114.368 -176.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.77 -33.84 76.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.357 1.435 . . . . 10.0 111.621 169.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.472 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.29 -45.11 77.54 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.73 1.612 . . . . 10.0 110.121 170.039 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -63.58 -35.56 80.91 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.99 1.316 . . . . 10.0 112.363 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -63.73 -48.97 74.9 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.822 1.649 . . . . 10.0 111.243 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.42 -35.41 62.88 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 61' ' ' GLU . 20.8 mm -59.37 -57.19 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.34 95.91 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.81 0.444 . . . . 10.0 111.946 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -53.53 -63.23 1.21 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.7 1.2 . . . . 10.0 111.522 170.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.24 -27.93 69.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.605 1.093 . . . . 10.0 113.426 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -59.54 -16.76 27.03 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.693 1.133 . . . . 10.0 113.511 170.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.41 33.57 3.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.801 2.04 . . . . 10.0 113.235 165.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.23 24.58 2.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.586 1.155 . . . . 10.0 111.398 171.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -127.68 2.25 6.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.573 1.549 . . . . 10.0 113.242 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -159.64 -59.0 0.06 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.344 1.857 . . . . 10.0 109.649 -154.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 C--O 1.256 1.426 0 CA-C-O 117.004 -1.474 . . . . 10.0 109.446 134.09 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.029 0 CA-C-O 117.478 -1.734 . . . . 10.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -131.01 168.15 17.85 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 -166.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.58 -65.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.23 2.612 . . . . 10.0 110.596 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.0 -37.59 74.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.404 1.482 . . . . 10.0 113.243 174.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 5.7 mmpt? -64.84 -16.4 63.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.659 -0.686 . . . . 10.0 112.315 171.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.06 -50.58 1.23 Allowed Glycine 0 N--CA 1.468 0.81 0 C-N-CA 125.974 1.749 . . . . 10.0 112.793 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -60.03 -29.62 68.62 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.629 1.215 . . . . 10.0 113.651 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 5' ' ' LYS . 15.8 pttp -64.22 -32.18 73.66 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.995 0.918 . . . . 10.0 112.532 174.46 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.82 -47.93 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.603 0.761 . . . . 10.0 109.244 168.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -57.54 -53.56 56.82 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.958 0.345 . . . . 10.0 111.46 -174.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.51 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 73.4 t -63.27 -15.42 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 112.706 0.632 . . . . 10.0 112.706 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -95.88 -63.74 1.12 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.051 2.141 . . . . 10.0 111.055 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -87.67 -17.9 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 -171.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -116.22 -52.63 2.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.148 0.979 . . . . 10.0 111.117 -169.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -74.57 3.71 7.27 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.564 0.95 . . . . 10.0 113.564 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.19 -67.22 0.27 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.439 1.896 . . . . 10.0 108.777 153.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.9 m -82.2 -35.36 28.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.137 1.375 . . . . 10.0 113.906 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.78 -163.0 0.96 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.861 2.465 . . . . 10.0 112.38 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' N ' ' A' ' 20' ' ' VAL . 8.3 t -138.15 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.477 1.111 . . . . 10.0 113.215 169.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' N ' HG23 ' A' ' 19' ' ' THR . 0.4 OUTLIER 40.97 -25.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.346 1 C-N-CA 132.86 4.464 . . . . 10.0 118.295 -161.994 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -140.55 -61.33 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.275 2.23 . . . . 10.0 109.742 -169.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -78.32 88.52 4.35 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.035 0.754 . . . . 10.0 113.035 177.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.42 0 N-CA-C 118.627 2.211 . . . . 10.0 118.627 150.409 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 119.425 -0.321 . . . . 10.0 111.716 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.56 163.22 28.99 Favored Glycine 0 CA--C 1.544 1.859 0 C-N-CA 124.984 1.278 . . . . 10.0 111.662 164.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.36 175.22 2.81 Favored 'Trans proline' 0 C--N 1.353 0.794 1 C-N-CA 125.653 4.236 . . . . 10.0 113.901 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -86.9 0.39 55.09 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.598 1.333 . . . . 10.0 114.598 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 mp 58.27 -31.63 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.105 3.362 . . . . 10.0 115.714 -174.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.09 68.13 0.16 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.549 3.14 . . . . 10.0 113.251 176.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.45 -51.74 2.21 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 126.75 2.119 . . . . 10.0 113.867 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 tp 66.86 -58.12 0.4 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.222 2.609 . . . . 10.0 115.252 173.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.16 115.77 6.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.392 1.077 . . . . 10.0 109.588 -170.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 -8.04 71.59 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 127.076 2.274 . . . . 10.0 114.217 -174.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -87.79 -83.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.082 1.353 . . . . 10.0 114.469 -168.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.65 175.42 1.09 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.341 2.656 . . . . 10.0 111.991 161.313 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.1 t -82.24 166.31 19.68 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.997 2.119 . . . . 10.0 111.371 163.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.12 -14.64 2.16 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 126.116 1.817 . . . . 10.0 116.789 159.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.72 -5.48 5.88 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 129.042 2.937 . . . . 10.0 115.333 -173.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -46.78 128.54 8.56 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 126.009 1.724 . . . . 10.0 111.851 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.62 106.4 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 123.233 2.622 . . . . 10.0 111.153 -172.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.53 -44.38 1.43 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.21 1.386 . . . . 10.0 113.724 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.43 134.48 56.49 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 122.467 1.127 . . . . 10.0 110.287 -173.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.4 m -150.73 86.36 1.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 123.607 1.67 . . . . 10.0 106.823 -156.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.48 142.8 30.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 131.621 3.968 . . . . 10.0 108.305 173.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.6 t 45.36 -138.31 0.49 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.74 0.816 . . . . 10.0 111.734 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -161.24 -65.69 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.032 1.733 . . . . 10.0 110.433 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.6 -54.69 43.01 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.085 1.354 . . . . 10.0 112.607 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -56.84 -45.86 82.09 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 119.676 1.126 . . . . 10.0 112.561 175.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mmmt -53.81 -49.94 67.24 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.386 1.074 . . . . 10.0 111.722 173.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -66.03 -38.41 88.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.842 1.257 . . . . 10.0 113.219 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -161.07 81.88 0.63 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.438 1.895 . . . . 10.0 110.726 -166.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -118.24 165.58 12.79 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.369 1.462 . . . . 10.0 111.289 164.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -68.11 169.34 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.929 1.691 . . . . 10.0 114.807 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.7 m -72.22 110.19 6.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.296 1.439 . . . . 10.0 111.06 167.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -61.66 140.83 58.12 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.425 1.09 . . . . 10.0 111.388 161.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -178.31 -33.03 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 125.731 1.612 . . . . 10.0 114.998 -169.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 166.46 -61.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.696 2.798 . . . . 10.0 112.306 158.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -41.49 85.31 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.84 1.256 . . . . 10.0 112.091 -177.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -54.71 -38.86 67.58 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.596 1.159 . . . . 10.0 112.579 168.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.2 mp -75.35 -28.64 59.66 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 119.881 1.219 . . . . 10.0 113.579 172.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 38.3 mtt -61.53 -53.61 54.11 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.987 1.267 . . . . 10.0 108.589 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.14 -37.81 88.6 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.699 0.285 . . . . 10.0 110.977 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.04 -45.54 81.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.198 -0.906 . . . . 10.0 113.183 175.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -37.88 89.05 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 120.931 1.696 . . . . 10.0 111.633 176.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -70.2 -24.65 63.15 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.726 1.38 . . . . 10.0 114.726 174.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.8 75.71 2.3 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 119.855 1.207 . . . . 10.0 114.01 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -70.88 -45.71 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.973 1.782 . . . . 10.0 112.224 -168.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -68.84 21.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.82 2.848 . . . . 10.0 114.658 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -161.47 -30.75 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.843 1.657 . . . . 10.0 112.786 -167.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.774 1.028 . . . . 10.0 113.774 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.11 157.11 79.11 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 125.419 1.488 . . . . 10.0 110.257 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.11 117.92 5.26 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.604 2.203 . . . . 10.0 110.603 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 85.64 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.802 1.191 . . . . 10.0 113.612 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -127.28 150.61 49.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.053 1.341 . . . . 10.0 110.53 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -142.0 26.6 1.85 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.763 1.625 . . . . 10.0 113.118 -171.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.3 ttt -55.8 103.97 0.12 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.84 0.856 . . . . 10.0 110.554 159.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.73 79.98 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.578 1.151 . . . . 10.0 109.467 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -161.91 -63.29 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.153 0.581 . . . . 10.0 111.983 174.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.48 -2.63 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 120.495 3.517 . . . . 10.0 120.495 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -145.6 86.47 0.17 Allowed Glycine 0 CA--C 1.529 0.937 0 CA-C-N 120.9 1.682 . . . . 10.0 112.262 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.8 tt -64.24 -57.76 10.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 114.12 1.155 . . . . 10.0 114.12 -170.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm 163.4 -168.75 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 131.667 3.987 . . . . 10.0 109.095 -174.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -53.12 -61.78 2.07 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 128.335 2.654 . . . . 10.0 115.582 -167.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.5 -40.61 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.518 1.527 . . . . 10.0 114.456 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -50.82 60.31 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.397 1.479 . . . . 10.0 111.656 -173.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -53.9 -49.06 69.43 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.389 0.675 . . . . 10.0 110.994 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -33.34 75.24 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.517 1.127 . . . . 10.0 112.788 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -76.68 -33.88 58.23 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 120.394 1.452 . . . . 10.0 114.428 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -69.91 -46.5 65.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.606 1.094 . . . . 10.0 112.069 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.58 -39.99 85.91 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.75 1.22 . . . . 10.0 113.265 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mm -65.0 -44.01 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.289 1.036 . . . . 10.0 110.479 173.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.73 -41.2 97.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.299 0.64 . . . . 10.0 111.75 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -56.72 -59.01 5.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.203 1.001 . . . . 10.0 112.418 170.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.8 -27.68 66.08 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.931 1.086 . . . . 10.0 113.931 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -58.89 -28.19 65.92 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.654 1.182 . . . . 10.0 112.637 167.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -81.94 -51.92 7.59 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.931 1.293 . . . . 10.0 111.549 167.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.45 -12.52 15.07 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 116.39 1.996 . . . . 10.0 116.39 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.3 t -72.3 -0.8 13.18 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.723 -1.235 . . . . 10.0 114.312 164.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -151.12 -22.32 0.21 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.94 1.696 . . . . 10.0 113.519 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 127.652 2.381 . . . . 10.0 109.965 172.148 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.822 0 CA-C-O 119.263 -0.743 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -127.78 136.55 51.64 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.623 0.725 . . . . 10.0 112.583 -150.096 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.49 -58.86 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.141 1.777 . . . . 10.0 110.989 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -60.25 -48.58 81.11 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.031 1.333 . . . . 10.0 113.153 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -53.33 -35.01 59.73 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.497 0.719 . . . . 10.0 111.721 170.02 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.31 -53.55 7.56 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.934 1.254 . . . . 10.0 110.38 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 97' ' ' TYR . 1.2 ptpt -58.75 -44.73 90.62 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.346 1.573 . . . . 10.0 112.679 177.154 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -39.7 79.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 118.07 -0.967 . . . . 10.0 112.898 -178.535 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -73.47 -33.16 39.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.929 1.241 . . . . 10.0 111.955 174.786 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -56.78 -50.56 71.95 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.284 -0.885 . . . . 10.0 110.077 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.487 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 55.2 t -60.15 -14.29 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 177.255 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -94.22 -56.62 2.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.267 1.427 . . . . 10.0 111.503 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -108.11 1.66 22.45 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.15 1.537 . . . . 10.0 115.15 -172.287 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.0 m -123.8 -49.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.126 1.37 . . . . 10.0 112.455 -179.773 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.487 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -69.68 2.93 2.81 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.921 1.082 . . . . 10.0 113.921 178.592 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -59.03 6.1 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.477 -0.764 . . . . 10.0 109.359 158.215 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.4 m -87.58 -28.06 22.16 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.608 1.336 . . . . 10.0 114.608 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -108.35 -168.95 1.43 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.795 2.038 . . . . 10.0 111.558 -176.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.285 6.5 t -137.33 -75.17 0.41 Allowed 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 117.471 -1.252 . . . . 10.0 113.33 165.188 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 6.7 p 45.58 -56.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 130.394 3.478 . . . . 10.0 116.587 -170.553 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -67.93 -10.14 50.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.245 1.818 . . . . 10.0 113.309 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -152.71 148.68 27.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.391 1.877 . . . . 10.0 110.356 -171.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 C-N-CA 125.486 1.517 . . . . 10.0 112.905 -176.359 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 119.698 -0.191 . . . . 10.0 111.045 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.67 176.91 16.57 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 126.047 1.784 . . . . 10.0 111.471 166.897 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.89 177.13 8.07 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.952 3.101 . . . . 10.0 112.266 177.246 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.53 10.48 27.71 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.941 2.096 . . . . 10.0 114.743 -175.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 mp 57.6 -16.59 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 128.809 2.844 . . . . 10.0 116.029 -176.557 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.94 68.99 0.15 Allowed 'General case' 0 C--O 1.24 0.591 0 C-N-CA 129.546 3.138 . . . . 10.0 115.768 156.738 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 67.02 2.37 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 125.503 1.525 . . . . 10.0 111.11 -176.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.01 171.29 2.28 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 117.993 0.896 . . . . 10.0 112.304 -176.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 76.37 130.09 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 127.642 2.377 . . . . 10.0 114.424 171.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.44 -39.82 1.5 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.004 1.764 . . . . 10.0 113.822 -179.207 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -169.93 0.68 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.777 1.631 . . . . 10.0 113.929 174.089 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.2 mtmm -77.43 -164.43 0.48 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.793 1.637 . . . . 10.0 113.036 -174.817 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -107.3 -99.03 0.36 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 117.586 -1.197 . . . . 10.0 109.981 168.451 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 7.54 -103.94 0.01 OUTLIER Glycine 0 N--CA 1.477 1.389 0 C-N-CA 130.144 3.735 . . . . 10.0 117.743 -177.797 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.9 mm-40 46.42 -14.27 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.087 1 C-N-CA 133.179 4.592 . . . . 10.0 121.695 161.208 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 109.98 2.85 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 121.377 1.899 . . . . 10.0 114.04 -174.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.26 62.59 8.49 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 124.037 3.158 . . . . 10.0 113.593 -167.263 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.45 50.97 0.08 OUTLIER Glycine 0 N--CA 1.473 1.11 0 C-N-CA 124.924 1.25 . . . . 10.0 113.299 175.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -145.92 -177.86 5.81 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.197 2.199 . . . . 10.0 108.078 -176.026 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.7 m -154.49 135.53 13.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 119.715 -1.866 . . . . 10.0 109.105 176.782 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -138.64 173.83 11.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.09 1.356 . . . . 10.0 112.061 -166.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.8 p -69.63 160.49 31.47 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.185 1.394 . . . . 10.0 112.557 172.617 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -64.8 -178.19 0.4 Allowed 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 114.916 -1.038 . . . . 10.0 111.041 161.44 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.02 -72.0 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.914 2.485 . . . . 10.0 114.02 -173.739 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -62.36 -64.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.153 0.978 . . . . 10.0 112.273 -169.09 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -39.64 43.95 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.531 -1.355 . . . . 10.0 113.869 175.308 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -65.63 -60.74 2.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.881 0.764 . . . . 10.0 112.741 178.34 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 56' ' ' GLY . 0.2 OUTLIER -77.37 -48.56 16.98 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.646 0.778 . . . . 10.0 112.766 -176.843 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 55' ' ' LYS . . . 71.11 176.3 23.03 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.123 1.344 . . . . 10.0 115.481 -177.82 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -168.46 2.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 127.568 2.347 . . . . 10.0 112.099 -165.325 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . 0.266 2.4 m 53.83 113.64 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.022 2.529 . . . . 10.0 114.979 -174.273 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -64.5 156.22 30.35 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.524 -1.216 . . . . 10.0 110.26 163.146 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -174.43 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.697 1.599 . . . . 10.0 112.104 -175.726 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 165.69 -64.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 130.484 3.514 . . . . 10.0 110.012 173.753 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -46.11 -56.54 5.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.357 1.863 . . . . 10.0 112.769 -179.764 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 75.7 p -61.41 -36.01 79.12 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.679 1.592 . . . . 10.0 112.163 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.466 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.32 -32.37 60.91 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.137 0.975 . . . . 10.0 113.051 173.918 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.9 mtm -63.62 -47.64 80.57 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 118.091 -0.957 . . . . 10.0 109.504 173.343 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -66.0 -43.01 88.99 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.554 0.616 . . . . 10.0 111.14 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -63.06 -49.8 73.11 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -177.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -43.11 92.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.779 1.172 . . . . 10.0 110.58 -178.954 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -74.11 -20.93 60.09 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.712 1.375 . . . . 10.0 114.712 -177.524 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.32 72.12 2.58 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 118.912 0.778 . . . . 10.0 111.355 178.212 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' HG21 ' A' ' 78' ' ' THR . 12.4 Cg_endo -62.91 -61.49 0.14 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.846 3.031 . . . . 10.0 115.44 -165.317 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -68.93 -26.06 64.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.035 0.934 . . . . 10.0 111.694 -178.127 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.38 90.95 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.861 1.264 . . . . 10.0 110.909 166.585 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -76.21 -53.9 7.58 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.266 -0.896 . . . . 10.0 113.299 178.414 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.56 119.51 15.18 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.952 1.301 . . . . 10.0 109.37 171.167 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.35 -30.71 44.53 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.864 2.376 . . . . 10.0 113.515 -168.112 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -74.92 70.62 1.75 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.177 0.894 . . . . 10.0 111.625 172.334 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.477 HG21 ' HB2' ' A' ' 71' ' ' PRO . 2.6 m -138.84 152.41 47.82 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.997 0.919 . . . . 10.0 111.43 172.607 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -141.41 12.87 2.16 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.237 1.815 . . . . 10.0 113.327 -178.848 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.2 ttt -55.03 93.02 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.255 1.822 . . . . 10.0 111.967 165.581 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.9 mm -71.79 76.65 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 124.812 1.245 . . . . 10.0 110.086 176.264 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -162.18 -74.09 0.05 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.959 0.726 . . . . 10.0 112.959 176.33 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.73 -67.94 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.443 2.697 . . . . 10.0 116.46 -169.29 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.9 82.1 0.12 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 125.984 1.754 . . . . 10.0 112.653 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 tt -61.43 -43.83 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 123.905 0.882 . . . . 10.0 112.293 -165.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.253 10.8 mtpt 161.45 -78.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 130.938 3.695 . . . . 10.0 110.061 146.026 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -77.0 -83.59 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt 173.69 -43.76 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 128.12 2.568 . . . . 10.0 110.706 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.7 m -50.53 -40.59 52.1 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.334 1.853 . . . . 10.0 112.168 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -59.89 -39.78 86.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.446 0.698 . . . . 10.0 111.072 177.237 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.466 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -62.67 -51.2 68.19 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.104 1.362 . . . . 10.0 109.881 -179.354 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.07 -26.68 59.54 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -66.66 -43.06 85.56 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.605 1.093 . . . . 10.0 110.916 168.968 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.35 -35.71 72.36 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.439 1.274 . . . . 10.0 114.439 174.949 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.36 -55.88 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 172.462 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -43.9 88.74 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.251 0.621 . . . . 10.0 111.946 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 101' ' ' ALA . 3.0 t80 -52.84 -63.41 1.15 Allowed 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.776 1.23 . . . . 10.0 111.739 170.565 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 89.6 mt -64.23 -30.1 71.17 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.719 1.145 . . . . 10.0 112.334 -174.335 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -57.69 -32.93 67.85 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.241 1.017 . . . . 10.0 112.497 171.627 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.5 mmtt -80.62 -53.37 6.6 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 125.065 1.346 . . . . 10.0 111.98 165.214 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.482 ' HB2' ' CE1' ' A' ' 97' ' ' TYR . . . -55.79 -24.3 34.96 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.319 1.97 . . . . 10.0 116.319 -167.143 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.5 t -74.14 2.11 9.7 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.126 0.971 . . . . 10.0 113.599 171.329 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -152.99 -18.55 0.15 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 127.941 2.496 . . . . 10.0 114.981 -179.578 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.064 2.146 . . . . 10.0 113.316 -171.996 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 109.266 -1.533 . . . . 10.0 109.266 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.569 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 1.8 m-20 -114.87 -113.56 0.34 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.463 1.505 . . . . 10.0 111.357 -165.397 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -161.51 -59.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 128.39 2.676 . . . . 10.0 107.499 -179.137 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.06 -48.83 75.31 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.398 1.079 . . . . 10.0 112.405 176.994 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -62.18 -14.89 42.28 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.965 1.098 . . . . 10.0 113.965 172.674 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.45 -55.8 2.52 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 125.292 1.425 . . . . 10.0 110.032 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 pttt -61.19 -37.48 83.11 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.144 0.972 . . . . 10.0 113.197 -176.463 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -13.95 60.91 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.216 1.191 . . . . 10.0 114.216 176.578 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.1 mm -103.22 -34.61 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.593 1.157 . . . . 10.0 111.222 169.711 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.6 t80 -54.67 -53.15 58.61 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.611 0.641 . . . . 10.0 110.793 172.065 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -66.61 -8.04 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.513 -0.742 . . . . 10.0 112.637 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.84 -50.04 5.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.501 1.92 . . . . 10.0 111.224 -177.078 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -122.82 -1.23 8.94 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -174.426 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 22.0 m -117.48 -46.2 2.69 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.562 1.145 . . . . 10.0 111.358 -177.355 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.08 -10.75 6.68 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.063 0.764 . . . . 10.0 113.063 168.296 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.06 -19.02 40.31 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.716 1.606 . . . . 10.0 113.042 166.148 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -143.4 -26.59 0.57 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.537 1.935 . . . . 10.0 115.074 -177.77 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -110.18 -172.84 2.12 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 128.056 2.542 . . . . 10.0 110.727 179.102 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.7 p -131.16 -82.68 0.52 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.863 1.06 . . . . 10.0 113.863 169.592 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.294 9.9 p 50.96 -45.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 131.507 3.923 . . . . 10.0 116.502 -169.752 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -72.81 -4.33 30.97 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.096 1.358 . . . . 10.0 112.165 170.079 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -151.66 173.41 14.71 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.588 1.955 . . . . 10.0 110.031 -166.631 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.152 0 C-N-CA 125.206 1.384 . . . . 10.0 116.512 -163.968 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -123.12 160.43 17.63 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.828 1.204 . . . . 10.0 111.116 166.122 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -66.56 6.45 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.742 1 C-N-CA 126.905 5.07 . . . . 10.0 117.378 -162.416 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 61.77 159.74 0.06 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.968 2.107 . . . . 10.0 112.171 -147.394 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.76 78.35 9.58 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.334 -1.358 . . . . 10.0 107.334 165.103 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 83.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.467 1.107 . . . . 10.0 110.928 176.748 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.87 -67.66 0.07 OUTLIER Glycine 0 CA--C 1.529 0.936 0 C-N-CA 128.047 2.737 . . . . 10.0 113.158 -178.7 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.57 -179.84 0.16 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.503 2.721 . . . . 10.0 111.43 -169.99 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 67.79 82.58 0.17 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.448 1.899 . . . . 10.0 113.504 -174.02 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.68 -33.69 4.02 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.234 1.873 . . . . 10.0 112.602 169.041 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -77.62 -168.16 1.12 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.046 1.338 . . . . 10.0 111.576 165.537 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.63 158.5 44.23 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.826 1.25 . . . . 10.0 110.044 -167.87 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -62.25 158.99 15.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 115.357 1.614 . . . . 10.0 115.357 -169.45 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.65 7.9 38.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.436 1.735 . . . . 10.0 117.436 169.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -100.65 12.35 37.6 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -161.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.42 146.08 89.91 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.031 0.932 . . . . 10.0 113.513 -178.559 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.63 58.92 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.727 2.951 . . . . 10.0 113.709 178.92 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 106.96 0.78 36.12 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 125.459 1.504 . . . . 10.0 116.134 168.019 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.63 132.97 51.23 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.969 1.385 . . . . 10.0 113.266 179.071 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -71.78 84.93 0.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.977 1.711 . . . . 10.0 112.219 175.782 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.404 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -82.77 175.19 10.31 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.105 1.362 . . . . 10.0 111.478 163.872 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -69.94 158.61 35.28 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.249 -0.907 . . . . 10.0 110.482 171.179 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 17.4 t0 -75.62 -9.32 58.49 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -178.479 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.16 -77.95 0.21 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.001 0.92 . . . . 10.0 113.162 -170.763 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -68.11 -23.81 64.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.828 1.418 . . . . 10.0 114.828 -163.084 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HG2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -64.62 -34.94 79.45 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.672 1.124 . . . . 10.0 113.3 169.501 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.82 -69.11 0.35 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.852 0.751 . . . . 10.0 110.693 162.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -76.92 60.81 1.84 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 10.0 112.414 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -85.09 -162.47 35.65 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.539 1.542 . . . . 10.0 114.637 -177.554 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.0 pt -169.06 146.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 127.79 2.436 . . . . 10.0 107.945 -166.468 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.0 m -72.59 124.4 25.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.058 1.343 . . . . 10.0 110.302 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -75.41 130.99 39.87 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 123.178 0.591 . . . . 10.0 111.277 175.651 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -164.47 161.49 21.4 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.447 2.299 . . . . 10.0 108.942 -168.151 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.99 46.82 0.06 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.58 1.952 . . . . 10.0 113.374 176.42 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -162.35 -62.14 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 129.25 3.02 . . . . 10.0 107.543 -171.171 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 44.5 p -65.99 -29.62 70.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 117.681 -1.152 . . . . 10.0 113.05 -177.071 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.27 -26.65 60.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.679 1.127 . . . . 10.0 112.908 169.577 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.2 mtt -65.54 -53.47 41.69 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.824 1.193 . . . . 10.0 108.421 172.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -67.33 -38.94 85.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.68 -0.236 . . . . 10.0 111.006 -176.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -60.72 -63.31 1.34 Allowed 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 119.044 -0.503 . . . . 10.0 111.453 173.071 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -32.83 74.56 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 120.155 1.343 . . . . 10.0 111.615 -169.941 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.48 -17.64 55.98 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.922 1.453 . . . . 10.0 114.922 175.501 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.09 56.26 0.81 Allowed Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.329 1.452 . . . . 10.0 112.189 -169.574 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.8 -50.92 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.661 2.241 . . . . 10.0 112.772 -159.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -64.27 -24.77 67.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.462 1.905 . . . . 10.0 112.865 -177.252 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -75.34 -54.13 7.58 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.948 1.299 . . . . 10.0 110.546 167.066 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -69.54 -30.71 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 -170.024 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 pt -140.43 118.13 8.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.465 1.106 . . . . 10.0 109.963 163.021 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.8 151.69 74.17 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.501 2.134 . . . . 10.0 111.484 -176.157 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.37 5.49 67.33 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 118.726 -1.041 . . . . 10.0 115.223 179.524 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 t -75.25 -3.56 33.93 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 116.258 1.947 . . . . 10.0 116.258 -170.302 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.2 tptp 59.28 -18.88 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 119.316 3.08 . . . . 10.0 119.316 159.812 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 19.3 ttt -46.32 114.6 0.83 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.904 2.481 . . . . 10.0 112.058 178.0 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.6 mp -82.43 52.72 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.715 1.206 . . . . 10.0 110.427 -176.973 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -164.06 150.98 11.7 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.02 1.728 . . . . 10.0 108.939 169.806 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.28 139.36 5.82 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.424 1.49 . . . . 10.0 108.69 177.461 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.19 87.88 0.49 Allowed Glycine 0 CA--C 1.529 0.911 0 CA-C-N 118.084 0.402 . . . . 10.0 112.837 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.3 tt -68.51 12.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.977 1.843 . . . . 10.0 115.977 -166.42 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 59.4 -0.26 0.18 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.881 2.549 . . . . 10.0 117.881 173.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -160.27 104.12 1.46 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.879 2.072 . . . . 10.0 109.199 -168.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -67.67 -13.77 62.37 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.338 1.607 . . . . 10.0 115.338 -177.319 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -62.76 -63.22 1.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.005 0.821 . . . . 10.0 109.323 163.432 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -50.87 -34.71 29.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.447 1.899 . . . . 10.0 112.814 176.695 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.2 tpm_? -51.18 -50.08 59.69 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 174.049 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -75.52 -43.47 48.79 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.952 1.701 . . . . 10.0 110.641 175.237 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.569 ' CG ' ' H ' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -57.3 -50.13 73.89 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.078 1.751 . . . . 10.0 112.124 -174.226 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -65.79 -38.68 89.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.4 0.546 . . . . 10.0 112.232 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.8 mt -61.38 -48.82 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.414 0.686 . . . . 10.0 109.492 176.578 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.67 93.85 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.748 1.219 . . . . 10.0 112.868 176.22 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.422 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -50.16 -53.29 28.72 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.023 1.329 . . . . 10.0 111.394 169.651 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 35.8 mt -67.54 -31.58 71.78 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.381 -0.824 . . . . 10.0 112.843 178.534 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -59.61 -26.88 65.82 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.323 1.231 . . . . 10.0 114.323 167.485 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.79 -54.36 9.07 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.011 0.823 . . . . 10.0 109.998 162.535 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.19 -25.48 33.02 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.512 1.671 . . . . 10.0 115.512 -175.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.25 5.6 11.89 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.052 1.341 . . . . 10.0 114.161 172.584 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -150.21 -15.63 0.25 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.564 1.946 . . . . 10.0 113.72 -170.948 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 C--O 1.258 1.515 0 C-N-CA 126.873 2.069 . . . . 10.0 110.221 -161.488 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.286 0 CA-C-O 119.59 -0.561 . . . . 10.0 111.973 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -131.79 122.3 25.57 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.299 1.04 . . . . 10.0 111.134 -157.068 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -52.82 -55.95 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.012 1.725 . . . . 10.0 111.71 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.8 -44.16 90.71 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 113.646 0.98 . . . . 10.0 113.646 -178.196 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.1 -36.12 72.42 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.156 0.582 . . . . 10.0 110.195 172.851 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.75 -45.54 16.87 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 124.68 1.133 . . . . 10.0 110.972 -175.029 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -74.95 -29.12 60.85 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -60.86 -53.48 56.78 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.43 1.013 . . . . 10.0 111.051 168.587 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.9 tp -64.23 -32.28 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 118.787 0.721 . . . . 10.0 112.001 177.34 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.494 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.7 t80 -59.37 -56.93 15.77 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 118.912 0.778 . . . . 10.0 111.311 170.874 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.32 -9.06 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 O-C-N 121.633 -0.667 . . . . 10.0 112.713 -178.353 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -63.67 1.25 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.743 1.217 . . . . 10.0 110.501 173.828 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -113.61 -2.78 13.72 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.774 1.768 . . . . 10.0 115.774 -167.795 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.3 m -103.44 -42.96 5.54 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 124.234 1.014 . . . . 10.0 111.23 171.051 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.01 -9.57 4.54 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.233 1.198 . . . . 10.0 114.233 173.191 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.73 -16.43 63.76 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.226 1.41 . . . . 10.0 112.979 167.855 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -143.54 -33.9 0.42 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.828 1.651 . . . . 10.0 113.928 -177.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.403 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 93.2 m-70 -100.76 -178.16 3.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.372 2.269 . . . . 10.0 110.621 173.443 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.4 t -175.74 117.25 0.15 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.38 1.072 . . . . 10.0 110.771 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.4 p -143.74 -63.64 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.217 1.407 . . . . 10.0 112.761 -173.899 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -66.45 -32.21 73.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 120.87 1.668 . . . . 10.0 110.507 170.153 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -68.05 120.74 14.78 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.745 1.218 . . . . 10.0 109.065 156.027 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.331 0 C-N-CA 123.91 0.767 . . . . 10.0 112.914 174.999 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.403 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -119.71 -178.94 16.51 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 126.3 1.905 . . . . 10.0 108.934 155.462 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 92.9 Cg_endo -72.84 -176.45 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 CA-C-N 120.03 1.915 . . . . 10.0 111.251 176.377 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -64.42 -35.92 82.48 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 179.342 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp 67.53 68.48 0.37 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.832 2.853 . . . . 10.0 111.006 -150.316 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.88 73.71 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.47 1.908 . . . . 10.0 112.619 161.501 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.58 -67.48 0.41 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 127.402 2.429 . . . . 10.0 114.706 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 54.1 -163.79 0.11 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.116 2.166 . . . . 10.0 113.084 -169.87 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 67.86 10.14 7.59 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.105 2.562 . . . . 10.0 114.743 -176.644 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -160.17 13.06 0.18 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.787 1.66 . . . . 10.0 114.16 -179.475 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.51 169.29 24.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.826 1.25 . . . . 10.0 111.943 -177.194 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -65.04 163.28 15.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.85 1.66 . . . . 10.0 112.564 179.245 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.4 p -69.82 164.58 23.34 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.414 0.686 . . . . 10.0 110.957 170.902 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.46 -112.76 3.78 Favored Glycine 0 N--CA 1.47 0.938 0 CA-C-O 118.193 -1.337 . . . . 10.0 115.68 169.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 38.37 2.41 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 1 C-N-CA 132.02 4.128 . . . . 10.0 121.104 178.756 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 30' ' ' PRO . . . -44.89 104.25 0.38 Allowed Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 127.653 2.381 . . . . 10.0 114.814 -178.612 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.91 50.73 3.57 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 123.778 2.985 . . . . 10.0 113.217 -172.303 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.69 49.75 0.1 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.573 1.558 . . . . 10.0 113.853 176.88 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 48' ' ' TYR . 2.9 t80 -148.97 118.0 6.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.257 1.023 . . . . 10.0 110.868 176.327 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.3 m -72.34 118.04 14.74 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.857 1.663 . . . . 10.0 111.088 176.35 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.701 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -127.89 177.19 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.371 1.868 . . . . 10.0 112.337 -175.639 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.6 p -77.65 142.66 38.73 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.282 -0.886 . . . . 10.0 111.788 168.845 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -65.11 -171.96 0.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.207 2.203 . . . . 10.0 112.769 163.92 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 59.1 -67.13 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.445 2.698 . . . . 10.0 112.093 -166.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -47.77 -31.73 5.17 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 130.209 3.404 . . . . 10.0 113.769 -179.301 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.701 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 27.4 mtmm -158.7 4.3 0.1 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 129.029 2.931 . . . . 10.0 112.467 -162.378 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.71 -62.48 1.37 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.672 0.789 . . . . 10.0 111.098 138.026 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -19.74 58.58 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.304 1.442 . . . . 10.0 114.812 -163.785 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.28 28.05 46.13 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-O 117.471 -1.738 . . . . 10.0 116.358 161.559 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 pp -54.98 20.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 130.346 3.458 . . . . 10.0 119.801 -167.418 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.2 m 55.64 99.27 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 128.865 2.866 . . . . 10.0 115.033 177.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -70.47 124.46 24.25 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.606 -0.684 . . . . 10.0 111.238 167.169 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt -163.86 170.18 17.18 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 129.565 3.146 . . . . 10.0 107.82 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -56.13 -33.61 65.33 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -60.86 -65.28 0.72 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.454 1.102 . . . . 10.0 111.887 171.693 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.0 p -62.69 -39.51 94.2 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.637 1.175 . . . . 10.0 111.981 -175.822 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.67 -16.99 59.39 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 174.954 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 29.0 mtm -68.27 -60.42 2.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.629 1.104 . . . . 10.0 108.741 160.566 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.63 -43.85 72.64 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.872 0.733 . . . . 10.0 111.006 -175.772 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -64.8 -54.97 22.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.151 -0.928 . . . . 10.0 113.07 178.038 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -26.09 65.37 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.741 1.61 . . . . 10.0 113.644 -178.688 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.46 -36.45 79.01 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.933 1.242 . . . . 10.0 112.614 171.153 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -161.58 96.01 1.3 Allowed Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.721 1.146 . . . . 10.0 112.594 169.638 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.67 -44.11 0.76 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.416 2.077 . . . . 10.0 111.098 -167.237 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -71.66 -24.08 61.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.092 1.757 . . . . 10.0 114.342 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -75.99 -40.11 54.47 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.886 1.221 . . . . 10.0 112.469 162.418 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -68.27 -41.06 81.62 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.258 0.836 . . . . 10.0 113.258 -176.482 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.47 156.96 69.29 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.244 1.018 . . . . 10.0 111.967 169.29 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.02 164.95 24.56 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.158 2.572 . . . . 10.0 114.833 -172.626 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.52 -77.43 0.09 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 127.157 2.313 . . . . 10.0 112.082 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m 58.8 -40.65 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 130.297 3.439 . . . . 10.0 118.954 164.266 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt 55.49 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 117.85 2.537 . . . . 10.0 117.85 174.629 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -64.59 79.52 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.054 1.742 . . . . 10.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tp -70.56 79.51 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.905 1.682 . . . . 10.0 111.395 178.096 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -161.12 -60.6 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 117.873 -1.061 . . . . 10.0 113.561 -176.25 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.14 91.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.931 2.197 . . . . 10.0 116.931 172.069 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.58 105.53 1.94 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 124.354 0.978 . . . . 10.0 111.285 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.5 tt -62.92 -56.3 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.439 0.903 . . . . 10.0 113.439 -165.435 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -162.34 -66.27 0.05 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.537 1.935 . . . . 10.0 111.111 174.049 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.9 mtmt -161.67 169.85 20.81 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.693 2.397 . . . . 10.0 107.886 -162.788 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -75.38 -11.35 60.03 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 -167.138 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.6 m -75.6 -56.17 4.95 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.942 1.247 . . . . 10.0 109.418 169.578 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -53.83 -36.79 62.93 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.819 2.047 . . . . 10.0 111.329 178.378 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -53.73 -46.11 70.74 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 126.833 2.053 . . . . 10.0 114.188 171.222 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -73.14 -45.12 58.55 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.112 0.965 . . . . 10.0 110.587 173.776 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -56.77 -49.23 75.92 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.781 1.232 . . . . 10.0 111.312 -170.264 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.1 -50.28 73.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.602 1.161 . . . . 10.0 112.538 174.365 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.8 mm -58.09 -47.18 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.182 0.993 . . . . 10.0 109.733 177.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.21 -47.32 85.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.585 1.154 . . . . 10.0 111.864 177.736 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -56.14 -56.79 16.61 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 118.661 -0.685 . . . . 10.0 112.081 173.375 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.69 -33.37 74.78 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.237 0.926 . . . . 10.0 112.484 -174.682 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -70.97 -23.58 62.24 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.381 1.252 . . . . 10.0 114.381 174.634 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -73.34 -59.23 2.81 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.687 -1.149 . . . . 10.0 110.825 159.605 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.86 -22.61 38.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 115.671 1.73 . . . . 10.0 115.671 -169.592 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 t -76.63 4.21 9.91 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.342 1.457 . . . . 10.0 114.582 169.92 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -150.37 -32.98 0.18 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.251 2.22 . . . . 10.0 112.925 -170.472 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 . . . . . 0 C--O 1.251 1.135 0 C-N-CA 127.595 2.358 . . . . 10.0 110.149 -156.93 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.988 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -156.67 170.94 21.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.941 1.371 . . . . 10.0 110.367 161.075 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.4 t -70.08 -67.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 126.267 1.827 . . . . 10.0 109.842 172.413 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -37.97 89.37 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.78 1.232 . . . . 10.0 112.509 179.74 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 mttp -73.17 4.56 4.31 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 118.094 -0.955 . . . . 10.0 113.422 168.464 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.63 -32.44 3.38 Favored Glycine 0 N--CA 1.472 1.036 0 CA-C-N 119.832 1.197 . . . . 10.0 114.505 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -29.72 65.4 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.791 1.796 . . . . 10.0 112.429 169.917 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.475 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.06 -15.73 63.31 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.372 1.619 . . . . 10.0 115.372 179.039 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.475 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 10.9 tp -110.46 -32.16 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.82 1.248 . . . . 10.0 111.252 170.375 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -54.61 -54.92 35.02 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 118.567 0.621 . . . . 10.0 110.088 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.32 -9.84 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.898 0.879 . . . . 10.0 112.673 -178.994 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -99.45 -35.81 9.78 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.26 1.824 . . . . 10.0 112.869 -173.348 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.42 -57.73 2.04 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.3 1.04 . . . . 10.0 111.709 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -56.52 -48.91 76.21 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.343 1.057 . . . . 10.0 112.24 -176.074 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.84 3.2 3.43 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.924 1.453 . . . . 10.0 114.924 174.967 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.37 -11.69 61.08 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 120.169 1.35 . . . . 10.0 111.854 162.089 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.18 -47.13 0.35 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.402 1.481 . . . . 10.0 112.33 -174.538 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -88.77 -170.71 3.03 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 127.194 2.197 . . . . 10.0 111.751 176.543 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.568 HG23 ' H ' ' A' ' 20' ' ' VAL . 5.1 t -131.52 -76.49 0.52 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.774 1.23 . . . . 10.0 113.666 -178.388 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.568 ' H ' HG23 ' A' ' 19' ' ' THR . 31.0 t 59.06 -60.46 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 129.925 3.29 . . . . 10.0 113.87 -174.934 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -128.35 -23.99 3.16 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 128.421 2.688 . . . . 10.0 110.52 -173.019 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -77.36 72.41 3.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.149 1.38 . . . . 10.0 110.681 168.261 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.27 0 C-N-CA 127.597 2.522 . . . . 10.0 115.613 169.797 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.1 m . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 115.74 1.755 . . . . 10.0 115.74 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.02 172.48 17.13 Favored Glycine 0 CA--C 1.544 1.889 0 C-N-CA 127.336 2.398 . . . . 10.0 111.885 160.549 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -75.87 -128.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.692 4.262 . . . . 10.0 110.725 175.596 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -144.76 -173.36 4.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.341 1.857 . . . . 10.0 109.784 -178.825 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.14 65.18 1.4 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 122.445 1.116 . . . . 10.0 109.497 175.891 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.31 77.06 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.16 2.584 . . . . 10.0 112.483 164.525 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.49 -58.31 0.3 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 128.976 3.179 . . . . 10.0 112.505 -172.387 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.263 0.1 OUTLIER 48.19 -106.54 0.17 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.658 2.383 . . . . 10.0 111.378 -165.516 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.327 9.6 m-85 33.86 39.7 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.171 2.988 . . . . 10.0 117.258 171.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 131.81 -16.08 5.08 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 126.82 2.153 . . . . 10.0 115.801 -175.306 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -64.23 -88.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.448 2.124 . . . . 10.0 113.967 -176.632 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.01 168.53 3.46 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 128.365 2.666 . . . . 10.0 111.641 163.159 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.7 p -67.53 163.26 21.52 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.448 2.299 . . . . 10.0 113.994 -177.755 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.75 9.37 81.21 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 117.979 1.952 . . . . 10.0 117.979 145.433 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -96.53 139.27 32.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.723 1.762 . . . . 10.0 113.199 -174.387 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.8 152.13 11.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.862 2.065 . . . . 10.0 108.741 160.713 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.24 67.97 8.43 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.987 2.458 . . . . 10.0 111.325 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.76 4.26 51.99 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 116.338 1.295 . . . . 10.0 116.338 169.746 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -70.1 175.04 4.79 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 119.173 1.486 . . . . 10.0 111.466 166.734 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -152.71 137.48 17.03 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.849 -1.157 . . . . 10.0 112.101 -174.753 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -156.66 169.42 24.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.591 2.356 . . . . 10.0 111.032 -153.715 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.8 p -64.86 122.95 18.14 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.026 0.83 . . . . 10.0 112.333 -172.032 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -35.55 71.28 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.716 1.376 . . . . 10.0 114.716 -159.495 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.73 -27.89 68.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -179.107 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -58.31 -62.66 1.67 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.082 0.953 . . . . 10.0 111.339 -175.854 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.445 ' H ' ' HD3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -45.79 -54.88 7.3 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.869 1.667 . . . . 10.0 110.189 177.953 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -65.96 -30.62 71.22 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.327 1.851 . . . . 10.0 114.51 -177.022 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -22.4 66.26 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 117.237 -1.363 . . . . 10.0 113.493 -179.135 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.04 -10.95 2.17 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 118.011 1.964 . . . . 10.0 118.011 154.637 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -15.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 128.521 2.728 . . . . 10.0 115.653 -178.28 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.9 m 58.39 128.48 0.01 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 131.201 3.8 . . . . 10.0 113.932 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -69.34 123.15 20.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.182 -0.917 . . . . 10.0 111.058 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.96 176.53 9.31 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 127.247 2.219 . . . . 10.0 109.466 -177.313 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -47.24 -26.87 1.31 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.79 2.836 . . . . 10.0 114.771 178.677 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -74.26 -71.27 0.34 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 10.0 112.519 167.194 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 56.8 p -75.37 -36.03 61.02 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 128.544 2.737 . . . . 10.0 112.074 -158.478 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.68 -21.28 59.49 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.571 1.148 . . . . 10.0 111.504 175.839 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.5 ttm -64.47 -53.95 40.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.153 0.581 . . . . 10.0 109.51 168.487 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -63.22 -46.89 84.89 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.595 0.559 . . . . 10.0 110.681 178.136 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.9 -48.04 72.79 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 113.331 0.863 . . . . 10.0 113.331 -174.314 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -17.93 59.79 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.638 1.563 . . . . 10.0 114.122 175.331 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -72.46 -33.3 66.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.989 1.722 . . . . 10.0 113.696 164.657 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.74 110.5 0.95 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 120.164 1.347 . . . . 10.0 113.713 158.622 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.19 -44.01 0.48 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.753 1.635 . . . . 10.0 112.174 -167.607 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.1 mtmp? -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.74 2.416 . . . . 10.0 113.259 178.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -70.55 -54.6 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.294 1.438 . . . . 10.0 109.368 172.245 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -72.81 -32.15 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.777 1.029 . . . . 10.0 113.777 -166.118 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 14.6 pt -137.11 143.89 43.85 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.069 0.948 . . . . 10.0 110.656 173.194 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.64 74.47 5.44 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.372 2.714 . . . . 10.0 112.941 -165.747 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.13 -100.72 0.18 Allowed Glycine 0 CA--C 1.524 0.611 0 C-N-CA 124.43 1.014 . . . . 10.0 111.554 166.35 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.8 m 51.04 93.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.03 2.532 . . . . 10.0 115.737 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -64.55 16.07 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 128.125 2.57 . . . . 10.0 115.271 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.5 ttt -69.76 90.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.302 1.441 . . . . 10.0 111.143 -178.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 81' ' ' ILE . 1.9 mp -66.34 69.58 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.607 1.963 . . . . 10.0 111.591 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -163.73 -42.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.943 1.697 . . . . 10.0 111.806 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.32 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 120.89 3.663 . . . . 10.0 120.89 178.501 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -166.39 147.09 11.61 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 121.427 1.922 . . . . 10.0 111.345 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.269 12.2 tt -71.23 -68.02 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.19 1.552 . . . . 10.0 115.19 -165.221 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.3 tttm -176.85 -51.25 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.156 1.782 . . . . 10.0 112.487 -179.381 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.479 ' HE3' ' HB ' ' A' ' 89' ' ' THR . 28.3 ttpt -164.24 146.87 9.12 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.947 2.099 . . . . 10.0 107.628 -160.491 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -58.84 -32.33 69.32 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 -176.146 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.479 ' HB ' ' HE3' ' A' ' 87' ' ' LYS . 4.9 m -61.67 -34.02 75.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.172 0.804 . . . . 10.0 113.172 174.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -76.3 -37.14 57.89 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.587 0.63 . . . . 10.0 111.73 171.475 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -55.15 -45.47 75.67 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.911 -1.118 . . . . 10.0 111.679 172.828 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -56.1 -53.89 51.58 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.623 1.169 . . . . 10.0 111.673 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -60.21 -34.87 74.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.528 0.731 . . . . 10.0 112.804 -169.079 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.49 -44.72 90.1 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.162 -0.961 . . . . 10.0 112.99 172.807 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.65 -46.82 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 109.158 -0.682 . . . . 10.0 109.158 177.624 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.76 -55.58 32.37 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.782 0.833 . . . . 10.0 111.903 173.288 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -50.68 -60.82 2.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.353 1.861 . . . . 10.0 112.505 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.9 -20.21 58.21 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.365 1.246 . . . . 10.0 114.365 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.445 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.6 OUTLIER -67.32 -29.35 68.89 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.166 1.348 . . . . 10.0 112.271 168.324 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -69.76 -39.73 76.53 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 117.674 -1.155 . . . . 10.0 112.24 165.305 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.86 -9.0 2.48 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 116.22 1.933 . . . . 10.0 116.22 -178.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 22.7 p -94.59 7.36 45.95 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.96 1.304 . . . . 10.0 114.016 167.133 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -150.68 -15.42 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.322 1.449 . . . . 10.0 113.495 -163.167 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 C--O 1.255 1.367 0 C-N-CA 130.21 3.404 . . . . 10.0 107.964 179.716 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 CA-C-O 119.71 -0.494 . . . . 10.0 112.356 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -86.94 103.13 15.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.221 1.408 . . . . 10.0 111.825 -163.854 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.7 m -60.54 -16.0 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 114.161 1.171 . . . . 10.0 114.161 -175.224 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -69.59 -59.6 2.86 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.873 2.069 . . . . 10.0 111.693 167.762 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -53.75 -27.79 30.69 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.842 0.857 . . . . 10.0 112.254 170.252 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.18 -47.76 12.46 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.699 1.142 . . . . 10.0 111.863 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.89 -39.9 79.51 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.397 1.099 . . . . 10.0 112.231 177.153 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -40.6 81.5 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.739 -1.6 . . . . 10.0 111.504 178.285 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.5 -33.61 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 121.559 1.981 . . . . 10.0 111.062 173.261 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -57.18 -53.78 54.24 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 118.854 0.752 . . . . 10.0 110.425 170.397 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.52 -10.34 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 N-CA-C 113.677 0.992 . . . . 10.0 113.677 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -96.81 -38.28 9.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.66 1.984 . . . . 10.0 111.598 -176.893 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -125.66 -17.35 5.51 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 115.031 1.493 . . . . 10.0 115.031 -172.292 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.0 m -112.49 -39.88 4.25 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 125.07 1.348 . . . . 10.0 112.235 -172.305 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.07 -17.31 9.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.743 0.645 . . . . 10.0 112.743 170.208 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.36 -29.07 32.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.061 1.744 . . . . 10.0 113.052 166.681 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.7 m -145.34 11.3 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 126.52 1.928 . . . . 10.0 114.983 -177.565 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -149.38 -178.3 6.34 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.106 1.321 . . . . 10.0 111.385 -177.453 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -150.91 172.76 15.16 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.357 -1.464 . . . . 10.0 108.071 151.11 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -166.09 -41.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.623 1.569 . . . . 10.0 111.869 162.365 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.81 82.71 0.11 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.729 0.812 . . . . 10.0 109.181 172.081 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 56.41 -174.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.883 2.073 . . . . 10.0 111.206 -166.897 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.613 0 N-CA-C 116.956 1.543 . . . . 10.0 116.956 170.373 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 116.123 1.897 . . . . 10.0 116.123 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.09 -176.4 14.4 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 120.168 1.349 . . . . 10.0 113.842 174.888 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.39 -2.59 12.63 Favored 'Trans proline' 0 CA--C 1.536 0.585 1 C-N-CA 125.978 4.452 . . . . 10.0 115.885 -175.819 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.421 0.1 OUTLIER 43.56 158.0 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.847 2.859 . . . . 10.0 117.336 -154.818 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.38 24.42 1.16 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 119.749 -1.844 . . . . 10.0 113.875 -167.747 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.457 ' CD2' HE21 ' A' ' 42' ' ' GLN . 0.2 OUTLIER -57.28 98.96 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 130.001 3.32 . . . . 10.0 114.436 -166.334 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.53 7.72 61.55 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.468 1.033 . . . . 10.0 114.378 176.557 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.49 178.4 0.42 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.115 1.458 . . . . 10.0 110.569 168.672 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.25 18.0 m-85 63.69 26.2 14.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 10.0 113.939 -159.068 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 176.61 15.11 0.02 OUTLIER Glycine 0 CA--C 1.536 1.39 0 C-N-CA 126.141 1.829 . . . . 10.0 114.716 -175.731 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -153.15 160.26 42.83 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.074 1.437 . . . . 10.0 111.304 -168.537 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.5 pttm -81.05 160.1 24.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.609 1.564 . . . . 10.0 112.762 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 t -58.47 150.07 23.54 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.082 -0.386 . . . . 10.0 110.354 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.24 63.6 0.8 Allowed Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.261 0.934 . . . . 10.0 112.138 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.457 HE21 ' CD2' ' A' ' 33' ' ' HIS . 13.3 pt20 -154.21 -19.49 0.13 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -177.585 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 136.15 96.59 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 119.169 0.895 . . . . 10.0 112.163 -168.993 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.91 72.96 5.0 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.631 2.887 . . . . 10.0 113.074 -168.743 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.01 2.37 52.24 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.77 1.468 . . . . 10.0 116.77 165.171 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.64 155.16 34.22 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 119.178 1.489 . . . . 10.0 111.163 175.433 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 m -71.72 74.87 0.84 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.341 1.456 . . . . 10.0 113.42 -176.978 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -83.67 172.88 11.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.752 1.621 . . . . 10.0 111.935 166.2 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.9 p -77.3 172.98 12.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 121.254 -0.904 . . . . 10.0 111.526 167.706 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -69.23 -63.28 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.095 -1.003 . . . . 10.0 111.392 169.288 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.8 -39.46 65.49 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.899 1.28 . . . . 10.0 113.92 -160.606 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -61.86 -38.44 88.25 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.678 0.791 . . . . 10.0 112.942 178.335 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.487 ' HE3' ' HA ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -77.19 -51.28 11.23 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.528 1.931 . . . . 10.0 110.701 173.834 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.36 -30.91 71.79 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.069 2.147 . . . . 10.0 113.32 -174.334 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 mmmm -159.99 16.58 0.14 Allowed 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.135 0.974 . . . . 10.0 113.391 -153.343 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.63 -133.61 0.67 Allowed Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.335 0.969 . . . . 10.0 111.878 163.941 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -170.23 -178.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.977 1.711 . . . . 10.0 110.521 -157.226 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 m -74.46 119.62 18.9 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.522 1.529 . . . . 10.0 111.194 172.437 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -77.14 62.07 2.16 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.461 1.504 . . . . 10.0 110.991 169.205 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -78.27 0.18 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 131.321 3.848 . . . . 10.0 115.643 -172.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 179.46 -9.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.992 2.917 . . . . 10.0 114.415 -176.307 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -81.82 -64.63 1.14 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.519 1.963 . . . . 10.0 112.857 160.099 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.8 p -54.74 -35.79 64.11 Favored 'General case' 0 N--CA 1.467 0.388 1 C-N-CA 132.078 4.151 . . . . 10.0 114.913 -165.613 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.6 mp -69.99 -24.56 63.33 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 117.606 -1.187 . . . . 10.0 113.103 175.327 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -41.91 68.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 120.55 1.523 . . . . 10.0 109.425 175.741 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -46.61 78.33 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.418 -0.513 . . . . 10.0 110.336 172.415 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -67.64 -43.6 79.93 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.711 1.004 . . . . 10.0 113.711 -174.712 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.35 -34.36 74.47 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.884 1.675 . . . . 10.0 112.572 177.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -76.36 -25.77 55.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.494 0.718 . . . . 10.0 112.694 177.147 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.58 74.63 2.11 Favored Pre-proline 0 CA--C 1.559 1.296 0 N-CA-C 113.275 0.842 . . . . 10.0 113.275 -178.25 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.29 -50.13 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.887 2.391 . . . . 10.0 112.487 -166.678 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -66.85 -22.26 65.99 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.798 1.639 . . . . 10.0 113.689 -178.747 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -75.41 -53.33 8.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.327 1.051 . . . . 10.0 110.274 166.602 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.34 -38.46 91.22 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.465 0.913 . . . . 10.0 113.465 -172.601 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.0 pt -131.69 117.72 16.48 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.773 0.829 . . . . 10.0 110.767 171.723 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.19 104.37 1.66 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.574 2.85 . . . . 10.0 111.798 -172.1 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.68 82.31 1.62 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.032 0.825 . . . . 10.0 111.594 178.189 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -133.22 -19.38 2.2 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.253 1.946 . . . . 10.0 116.253 -169.812 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 55.47 2.29 0.06 Allowed 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 117.039 2.236 . . . . 10.0 117.039 173.461 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.2 ttt -62.93 81.45 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 120.302 1.41 . . . . 10.0 110.081 161.873 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.49 90.26 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.956 1.303 . . . . 10.0 109.359 176.063 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -161.6 -68.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 118.32 -0.848 . . . . 10.0 112.825 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.17 89.08 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 127.237 2.215 . . . . 10.0 116.527 172.775 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.38 92.56 2.05 Favored Glycine 0 CA--C 1.532 1.101 0 O-C-N 121.691 -0.631 . . . . 10.0 113.179 175.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 17.8 tt -64.38 -36.82 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 115.808 1.781 . . . . 10.0 115.808 -167.498 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttm 164.41 -165.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 129.413 3.085 . . . . 10.0 108.501 -161.665 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.51 ' HE2' ' HG2' ' A' ' 90' ' ' GLU . 40.8 pttt -52.63 153.32 3.19 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.973 1.709 . . . . 10.0 110.91 167.088 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -73.16 71.45 1.16 Allowed 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 123.325 1.536 . . . . 10.0 110.774 171.656 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.3 m -151.89 -54.34 0.13 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 125.903 1.681 . . . . 10.0 108.259 169.587 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG2' ' HE2' ' A' ' 87' ' ' LYS . 18.6 mm-40 -56.7 -38.83 72.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.762 0.71 . . . . 10.0 111.313 172.47 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -30.98 71.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.153 0.581 . . . . 10.0 111.907 174.92 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.05 -36.08 61.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.068 0.947 . . . . 10.0 111.239 173.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.59 -48.08 70.69 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.646 1.978 . . . . 10.0 111.186 175.35 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.23 -53.91 30.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.949 2.1 . . . . 10.0 112.668 174.681 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.26 -38.88 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 122.781 0.432 . . . . 10.0 110.274 -178.763 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.7 99.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 122.525 0.33 . . . . 10.0 111.647 173.375 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.401 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -56.6 -60.85 2.93 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.476 1.11 . . . . 10.0 111.195 172.287 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 60.2 mt -61.04 -36.78 80.48 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.543 1.065 . . . . 10.0 112.728 -175.626 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.91 -32.57 61.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 117.891 -1.052 . . . . 10.0 112.721 174.478 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -101.13 -35.79 9.19 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 175.584 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.61 -27.53 64.77 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.969 1.713 . . . . 10.0 113.506 -178.262 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.9 t -65.38 -11.65 44.4 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.835 1.254 . . . . 10.0 114.363 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.71 51.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.031 2.132 . . . . 10.0 111.029 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 113.388 0.885 . . . . 10.0 113.388 172.026 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.29 119.88 19.25 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.814 1.246 . . . . 10.0 110.501 -161.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.472 HG23 ' HA ' ' A' ' 97' ' ' TYR . 7.3 p -56.24 -34.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 O-C-N 121.48 -0.763 . . . . 10.0 111.294 172.482 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.2 mp0 -60.72 -48.02 83.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 126.528 1.931 . . . . 10.0 111.164 -171.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mtmp? -75.68 -23.64 56.23 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.069 1.748 . . . . 10.0 113.568 167.579 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.27 -46.42 7.54 Favored Glycine 0 N--CA 1.464 0.555 0 O-C-N 121.236 -0.915 . . . . 10.0 111.78 -168.54 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -41.48 50.79 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.923 1.289 . . . . 10.0 113.408 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -71.72 -37.86 70.57 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.709 -1.139 . . . . 10.0 113.763 179.228 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.27 -35.61 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 120.372 1.442 . . . . 10.0 109.996 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.436 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 32.6 t80 -57.08 -51.11 70.61 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.222 0.919 . . . . 10.0 110.624 173.606 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.22 -16.63 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 113.968 1.099 . . . . 10.0 113.968 177.033 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.2 -34.76 25.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.535 1.134 . . . . 10.0 111.953 -173.768 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -136.53 -58.95 0.73 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.799 1.639 . . . . 10.0 110.334 -163.626 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 8.9 m -58.45 -45.9 87.64 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.806 1.243 . . . . 10.0 111.999 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -8.78 17.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.713 1.375 . . . . 10.0 114.713 175.497 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -10.22 59.48 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.01 -1.056 . . . . 10.0 112.412 169.774 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 87.3 m -142.87 -27.55 0.58 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -173.024 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -116.72 168.12 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.333 2.253 . . . . 10.0 112.956 -176.251 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -136.07 137.78 41.45 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.859 1.263 . . . . 10.0 109.855 165.825 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.2 p -166.26 -32.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.923 1.289 . . . . 10.0 111.738 172.364 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -48.21 -38.06 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.36 2.264 . . . . 10.0 115.311 175.615 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.46 148.47 16.38 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.489 1.916 . . . . 10.0 108.14 168.346 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.197 0 CA-C-O 121.583 0.546 . . . . 10.0 112.05 -172.336 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.472 0.653 0 CA-C-O 118.873 -0.584 . . . . 10.0 111.604 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.97 167.06 22.97 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 109.782 -1.327 . . . . 10.0 109.782 149.018 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.0 155.49 52.78 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 10.0 112.135 179.722 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.69 129.68 40.73 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.068 -1.02 . . . . 10.0 109.82 165.543 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.32 70.36 2.92 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.571 1.653 . . . . 10.0 112.592 -167.311 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.65 88.61 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.583 1 C-N-CA 132.576 4.35 . . . . 10.0 115.112 -178.931 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.58 27.23 70.62 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.245 0.926 . . . . 10.0 114.938 162.652 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.5 mp -53.37 166.06 0.31 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.834 1.654 . . . . 10.0 111.905 178.946 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 29.1 m-85 65.36 59.37 0.8 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.007 1.723 . . . . 10.0 113.246 -174.067 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 161.35 -46.01 0.38 Allowed Glycine 0 CA--C 1.53 0.986 0 CA-C-N 115.533 -0.758 . . . . 10.0 114.187 167.167 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.11 169.51 13.06 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.976 0.91 . . . . 10.0 112.13 177.086 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.1 pttm -74.74 -20.52 59.79 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 115.055 1.502 . . . . 10.0 115.055 -165.828 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.453 HG21 ' H ' ' A' ' 59' ' ' TRP 0.288 29.6 p 88.05 167.5 0.06 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 129.417 3.087 . . . . 10.0 112.659 175.449 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 70.21 116.77 0.04 OUTLIER Glycine 0 CA--C 1.541 1.664 0 C-N-CA 123.109 0.385 . . . . 10.0 112.217 -154.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -159.45 4.87 0.09 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.393 1.877 . . . . 10.0 113.861 168.932 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -50.86 108.98 1.16 Allowed Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 125.966 1.707 . . . . 10.0 114.651 -164.821 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.6 65.61 8.09 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.386 3.391 . . . . 10.0 112.944 -171.459 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 107.64 60.26 0.56 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.798 1.19 . . . . 10.0 113.171 174.553 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -143.81 169.66 17.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.182 1.393 . . . . 10.0 109.607 177.286 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -153.25 151.79 30.44 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.585 0.754 . . . . 10.0 110.772 177.825 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.402 ' CD2' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -157.76 -92.89 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 10.0 111.22 -153.899 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -145.8 -1.64 0.77 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.129 2.172 . . . . 10.0 114.106 -177.006 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 45.46 -95.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.923 2.089 . . . . 10.0 112.613 -157.653 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 30.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.697 3.199 . . . . 10.0 115.558 170.869 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -43.95 -56.61 3.82 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.782 2.033 . . . . 10.0 111.695 174.206 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.402 ' HE3' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -62.01 -40.09 94.49 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.263 1.825 . . . . 10.0 111.087 -177.397 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -63.41 -48.6 77.13 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.227 1.411 . . . . 10.0 111.533 176.259 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -62.18 -24.09 66.99 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.714 1.206 . . . . 10.0 113.701 -174.606 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.4 36.66 93.68 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.375 0.989 . . . . 10.0 114.184 171.083 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -1.44 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.869 2.067 . . . . 10.0 116.084 -174.486 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.8 m 56.27 92.59 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.606 1.963 . . . . 10.0 113.184 -179.689 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.453 ' H ' HG21 ' A' ' 40' ' ' THR . 10.5 m95 -58.68 125.75 24.75 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.427 168.954 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.424 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 0.6 OUTLIER -162.76 178.62 8.31 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.782 2.833 . . . . 10.0 109.177 -178.237 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -67.17 35.36 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 129.637 3.175 . . . . 10.0 114.574 -172.794 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -160.89 -63.8 0.06 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 127.904 2.482 . . . . 10.0 108.432 -174.63 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.5 p -57.92 -46.93 84.25 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.116 1.366 . . . . 10.0 111.673 179.484 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.44 -29.09 66.72 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.563 1.145 . . . . 10.0 111.783 175.519 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 30.3 ttm -68.77 -43.69 75.24 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 118.275 0.489 . . . . 10.0 111.105 175.663 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -67.91 -45.79 73.37 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 117.908 0.322 . . . . 10.0 110.184 173.305 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.5 -57.72 11.53 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 118.107 -0.949 . . . . 10.0 112.45 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -34.05 76.72 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.549 1.522 . . . . 10.0 111.904 -174.573 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -73.02 -22.05 60.72 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.634 1.716 . . . . 10.0 115.634 175.265 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -161.47 63.15 1.61 Allowed Pre-proline 0 CA--C 1.556 1.189 0 CA-C-N 120.156 1.344 . . . . 10.0 114.384 178.857 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.208 1.939 . . . . 10.0 113.072 -159.18 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -71.17 -20.47 62.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.703 2.001 . . . . 10.0 112.745 -178.248 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.23 -51.99 10.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.521 1.129 . . . . 10.0 110.231 164.149 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -60.49 -44.99 95.37 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.87 1.063 . . . . 10.0 113.87 -173.619 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 pt -137.08 124.35 14.07 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.992 . . . . 10.0 110.436 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -78.07 60.24 7.28 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.407 3.405 . . . . 10.0 112.696 -167.546 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.85 66.38 0.04 OUTLIER Glycine 0 CA--C 1.523 0.584 0 O-C-N 121.567 -0.708 . . . . 10.0 113.338 179.152 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 4.5 m -135.91 125.35 25.0 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.886 0.874 . . . . 10.0 111.871 173.993 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -86.39 -3.53 59.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.783 1.401 . . . . 10.0 114.783 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.1 ttt -50.11 101.83 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.972 1.709 . . . . 10.0 113.7 -174.816 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 27.3 mm -78.22 72.96 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.224 1.41 . . . . 10.0 109.583 175.596 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -163.58 -49.42 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.851 1.26 . . . . 10.0 111.139 169.431 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.93 32.53 1.35 Allowed 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 118.081 2.623 . . . . 10.0 118.081 164.52 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 179.0 -161.11 27.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.965 1.269 . . . . 10.0 111.441 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.2 tt -147.68 -175.37 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.554 0.742 . . . . 10.0 111.71 165.992 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -77.89 -30.47 50.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.939 1.296 . . . . 10.0 114.492 -164.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -161.63 -68.96 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 116.588 -1.672 . . . . 10.0 111.755 -170.069 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 pttm 174.98 -40.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.777 2.031 . . . . 10.0 115.815 164.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 m -58.39 -30.3 66.71 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.732 1.606 . . . . 10.0 112.04 -178.657 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.3 mp0 -59.42 -29.08 67.5 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.23 -0.919 . . . . 10.0 112.366 173.044 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -67.13 -55.57 13.66 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 119.189 0.904 . . . . 10.0 111.63 -178.476 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -61.06 -34.67 75.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.933 1.293 . . . . 10.0 111.618 175.152 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -67.33 -45.9 75.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.145 0.884 . . . . 10.0 112.545 174.87 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.14 -38.36 90.36 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.334 -0.854 . . . . 10.0 113.019 174.744 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mt -61.16 -51.21 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 118.566 -0.73 . . . . 10.0 109.6 170.941 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -41.64 85.31 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.876 0.762 . . . . 10.0 112.557 177.919 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.472 ' HA ' HG23 ' A' ' 3' ' ' VAL . 2.7 t80 -50.36 -65.73 0.51 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 124.407 1.083 . . . . 10.0 111.557 169.414 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.4 -36.01 82.3 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.491 0.587 . . . . 10.0 112.131 -175.908 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -65.75 -21.61 66.53 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.423 1.489 . . . . 10.0 114.263 176.029 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -87.79 -52.56 5.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.466 1.03 . . . . 10.0 111.422 160.877 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -26.05 52.97 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 -170.795 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.5 t -74.11 -1.86 22.03 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.42 1.488 . . . . 10.0 114.126 172.674 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -154.08 -18.61 0.13 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 117.12 2.267 . . . . 10.0 117.12 -178.621 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.074 -1.917 . . . . 10.0 114.561 177.952 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 CA-C-O 118.828 -0.984 . . . . 10.0 111.347 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -140.74 160.12 40.73 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.287 1.588 . . . . 10.0 115.287 -149.023 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.17 -53.0 54.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 125.817 1.647 . . . . 10.0 112.749 -179.22 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -44.45 97.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.786 1.176 . . . . 10.0 113.335 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -56.13 -36.22 68.0 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.675 0.75 . . . . 10.0 110.793 172.387 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.37 -51.42 6.7 Favored Glycine 0 C--O 1.224 -0.512 0 C-N-CA 125.248 1.404 . . . . 10.0 110.288 -173.724 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -37.52 83.38 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.111 1.456 . . . . 10.0 112.637 177.248 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -59.94 -56.79 17.33 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.625 0.77 . . . . 10.0 111.594 174.724 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -31.76 47.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 118.438 0.563 . . . . 10.0 111.816 -178.45 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -56.41 -51.08 69.69 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.371 -1.455 . . . . 10.0 110.576 168.48 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.68 -15.53 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 113.682 0.993 . . . . 10.0 113.682 178.375 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -90.09 -43.6 10.38 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.025 1.33 . . . . 10.0 111.78 -179.631 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -119.2 -11.37 9.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.932 1.456 . . . . 10.0 114.932 -169.591 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -120.32 -44.17 2.49 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.451 1.5 . . . . 10.0 111.434 -172.345 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.31 -11.17 20.03 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.696 0.998 . . . . 10.0 113.696 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.25 -25.95 26.18 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.953 2.101 . . . . 10.0 112.553 164.04 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.8 m -141.68 -19.29 0.75 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 10.0 113.629 -173.378 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -130.25 86.16 2.37 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 10.0 110.897 -177.067 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.2 p -69.69 18.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.574 2.064 . . . . 10.0 116.574 -167.467 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.71 -35.07 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 O-C-N 120.642 -1.286 . . . . 10.0 113.509 -160.509 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -62.99 -0.84 0.76 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.131 1.772 . . . . 10.0 114.271 177.077 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -150.28 13.68 0.77 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.109 2.164 . . . . 10.0 111.561 178.128 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.126 0 C-N-CA 125.137 1.351 . . . . 10.0 112.312 -169.686 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.477 0.925 0 CA-C-O 118.254 -0.879 . . . . 10.0 113.248 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -124.98 170.99 16.95 Favored Glycine 0 CA--C 1.54 1.653 0 CA-C-N 119.657 1.117 . . . . 10.0 111.95 167.125 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.24 44.18 1.6 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 124.908 3.739 . . . . 10.0 113.969 -153.197 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 48.14 18.84 0.16 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.172 2.189 . . . . 10.0 115.963 -178.378 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt 33.37 64.6 0.3 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.964 2.905 . . . . 10.0 112.835 -179.181 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -54.11 80.48 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.83 2.452 . . . . 10.0 111.748 172.098 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.04 -47.89 0.07 OUTLIER Glycine 0 CA--C 1.536 1.358 0 C-N-CA 129.827 3.584 . . . . 10.0 116.237 -179.176 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.276 8.6 mp 53.78 -148.8 0.44 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.533 1.933 . . . . 10.0 110.295 -165.67 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 34.8 59.52 0.68 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.148 2.179 . . . . 10.0 114.959 178.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 115.81 -27.2 8.43 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.693 2.092 . . . . 10.0 113.17 -174.621 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -69.49 74.26 0.38 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.071 1.348 . . . . 10.0 111.344 170.087 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt 34.03 -125.25 0.09 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 129.927 3.291 . . . . 10.0 113.776 161.853 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.41 HG22 ' HA ' ' A' ' 53' ' ' LYS . 3.7 m -149.52 -79.62 0.13 Allowed 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.163 -1.585 . . . . 10.0 109.742 171.927 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.59 88.47 0.73 Allowed Glycine 0 CA--C 1.535 1.296 0 O-C-N 120.357 -1.464 . . . . 10.0 115.541 179.816 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -134.4 9.53 3.72 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.452 1.279 . . . . 10.0 114.452 -178.085 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.8 140.34 93.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 121.031 -1.043 . . . . 10.0 112.266 -176.735 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -77.61 52.34 3.91 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 124.104 3.203 . . . . 10.0 112.876 -177.382 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.88 -96.49 0.37 Allowed Glycine 0 CA--C 1.527 0.785 0 C-N-CA 126.347 1.927 . . . . 10.0 110.869 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.7 t80 32.8 100.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.758 2.823 . . . . 10.0 117.234 165.856 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 m -66.33 90.25 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.168 -0.957 . . . . 10.0 112.258 168.173 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -83.13 174.0 11.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.298 1.439 . . . . 10.0 110.447 161.753 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.0 p -74.42 30.88 0.08 Allowed 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -174.05 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.5 t70 45.73 -69.02 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 129.849 3.259 . . . . 10.0 115.593 -166.422 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.04 -45.73 61.4 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.026 1.73 . . . . 10.0 113.552 -150.29 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -45.9 -70.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.38 1.472 . . . . 10.0 111.748 171.323 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.41 ' HA ' HG22 ' A' ' 40' ' ' THR . 18.9 mtpp -71.19 -25.37 62.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.581 1.552 . . . . 10.0 112.447 -171.197 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.56 -45.93 92.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.51 1.524 . . . . 10.0 112.697 161.672 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.71 -24.13 65.35 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.27 0.941 . . . . 10.0 113.184 -170.198 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.77 26.9 70.19 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-O 119.1 -0.833 . . . . 10.0 115.072 163.46 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -3.96 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 115.847 1.795 . . . . 10.0 115.847 -171.615 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.4 m 57.86 108.9 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.565 2.346 . . . . 10.0 114.002 -170.551 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -67.24 119.76 12.67 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.284 -0.871 . . . . 10.0 112.349 173.067 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -166.63 -175.92 3.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.742 2.817 . . . . 10.0 108.768 175.894 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -45.59 -53.08 9.63 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.645 1.578 . . . . 10.0 111.635 176.689 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.67 15.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.862 2.065 . . . . 10.0 116.047 -174.833 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.9 p -157.73 -39.26 0.07 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.94 -1.1 . . . . 10.0 110.879 -169.221 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -30.19 59.65 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.181 1.355 . . . . 10.0 112.787 174.841 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -51.03 58.46 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 119.613 1.097 . . . . 10.0 108.616 174.743 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.81 -37.74 87.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.506 0.722 . . . . 10.0 110.653 -179.807 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -66.06 -65.38 0.68 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.403 -0.808 . . . . 10.0 112.561 173.91 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -17.26 64.71 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.818 1.645 . . . . 10.0 114.301 -172.756 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.93 -32.05 71.38 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.806 1.185 . . . . 10.0 113.557 165.488 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -163.23 79.31 1.67 Allowed Pre-proline 0 CA--C 1.549 0.933 0 CA-C-N 119.754 1.161 . . . . 10.0 111.642 177.262 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.36 -52.25 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.189 1.926 . . . . 10.0 110.873 -163.919 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -67.78 24.88 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.767 2.827 . . . . 10.0 114.568 -177.941 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.91 -28.8 0.06 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.921 2.089 . . . . 10.0 111.894 -175.081 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -64.62 -38.6 91.56 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 119.273 0.942 . . . . 10.0 112.006 165.376 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.4 pt -133.78 151.08 76.34 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 124.239 1.016 . . . . 10.0 111.381 176.039 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.1 162.2 41.36 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.725 2.284 . . . . 10.0 111.213 173.973 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 39.7 61.85 1.51 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.955 1.74 . . . . 10.0 114.775 172.926 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.9 t -121.08 -14.41 8.41 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.101 1.519 . . . . 10.0 115.101 178.198 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? 54.5 -67.14 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 127.668 2.387 . . . . 10.0 116.071 179.219 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.1 ttt 13.53 85.17 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 130.961 3.704 . . . . 10.0 113.838 -177.15 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -70.53 80.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.856 1.263 . . . . 10.0 109.553 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -162.95 -51.83 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.455 1.502 . . . . 10.0 111.19 172.086 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 35.15 57.6 0.79 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.845 2.458 . . . . 10.0 116.449 170.789 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 161.41 -166.96 36.11 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.457 1.027 . . . . 10.0 111.594 179.446 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 tt -158.08 178.15 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.826 1.65 . . . . 10.0 109.475 166.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -88.9 166.96 13.61 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.844 1.202 . . . . 10.0 111.047 178.062 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . 0.258 8.6 ptpp? 40.21 -103.53 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.602 1.961 . . . . 10.0 112.153 -172.522 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.2 tttp -163.17 -32.95 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.828 1.251 . . . . 10.0 112.578 154.003 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.9 m -59.06 -21.39 59.09 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 -178.882 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -54.64 -32.77 59.57 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.067 -1.021 . . . . 10.0 112.354 167.444 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.35 -22.36 61.17 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.226 1.411 . . . . 10.0 112.744 175.423 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.26 -53.91 7.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.238 1.015 . . . . 10.0 110.402 164.509 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.65 1.58 . . . . 10.0 111.735 -169.878 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 mp -53.69 -42.95 68.52 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 114.499 1.296 . . . . 10.0 114.499 173.668 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.8 mm -66.09 -50.86 66.06 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.238 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.132 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.42 66.28 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.916 -1.04 . . . . 10.0 113.301 179.471 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -66.51 -69.2 0.32 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.67 1.988 . . . . 10.0 112.557 159.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.79 -20.6 63.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.085 0.772 . . . . 10.0 113.085 -173.785 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.17 -35.52 62.4 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.883 2.073 . . . . 10.0 113.371 166.815 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -81.27 -46.0 15.42 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.037 1.335 . . . . 10.0 110.874 171.399 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.2 -1.02 0.27 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.453 2.39 . . . . 10.0 117.453 -166.938 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.7 t -133.85 15.42 3.94 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.838 1.255 . . . . 10.0 114.227 168.4 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -151.02 -13.48 0.22 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.767 1.627 . . . . 10.0 114.172 -169.804 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.949 1.699 . . . . 10.0 114.25 177.214 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.942 0 CA-C-O 117.914 -1.492 . . . . 10.0 111.792 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -139.53 164.59 29.48 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.119 1.459 . . . . 10.0 114.823 -173.601 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.4 t -75.29 -61.22 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 126.281 1.832 . . . . 10.0 109.879 165.355 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -60.0 -47.36 86.14 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.986 -1.071 . . . . 10.0 113.531 -175.236 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -59.16 -31.47 69.01 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 117.871 0.305 . . . . 10.0 111.226 172.918 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.23 -50.94 19.82 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 125.858 1.694 . . . . 10.0 111.379 178.692 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -32.7 74.36 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 117.879 0.84 . . . . 10.0 111.813 -179.337 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -63.26 -55.2 26.84 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.802 1.241 . . . . 10.0 111.413 173.055 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.251 0.2 OUTLIER -68.3 -30.17 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 CA-C-N 118.473 0.579 . . . . 10.0 111.747 -179.474 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -56.35 -54.06 49.93 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 120.468 -1.395 . . . . 10.0 110.83 164.809 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.2 t -62.23 -13.93 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 O-C-N 121.308 -0.87 . . . . 10.0 113.209 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -91.93 -42.16 10.19 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.641 1.177 . . . . 10.0 112.285 178.508 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -124.44 -3.06 7.93 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.63 1.715 . . . . 10.0 115.63 -168.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.7 m -120.67 -43.9 2.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.909 1.684 . . . . 10.0 111.0 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.64 -4.37 8.62 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.493 1.294 . . . . 10.0 114.493 176.304 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.47 -12.38 60.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.64 1.176 . . . . 10.0 113.964 164.885 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.63 -40.57 0.29 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.622 1.569 . . . . 10.0 112.49 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -93.68 -161.61 0.86 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 127.504 2.322 . . . . 10.0 109.034 166.246 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 m -154.8 -55.07 0.1 Allowed 'General case' 0 N--CA 1.482 1.175 0 O-C-N 119.847 -1.783 . . . . 10.0 112.574 165.281 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t 61.2 -71.75 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.085 1.754 . . . . 10.0 114.422 177.568 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.35 -52.75 64.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.342 1.057 . . . . 10.0 111.769 -166.817 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -153.17 100.27 2.45 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.953 1.301 . . . . 10.0 110.582 -171.399 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.255 0 N-CA-C 117.003 1.561 . . . . 10.0 117.003 165.505 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.89 156.61 26.92 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-N 120.681 1.582 . . . . 10.0 112.328 167.656 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.99 3.91 3.6 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 124.79 3.66 . . . . 10.0 117.088 -151.04 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 64.32 149.12 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.482 2.713 . . . . 10.0 112.654 -144.646 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -83.54 50.0 1.7 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.647 1.179 . . . . 10.0 110.691 176.135 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.46 98.45 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 128.267 2.627 . . . . 10.0 113.821 -173.92 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 17.96 68.02 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.562 1.077 . . . . 10.0 114.651 173.894 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -61.06 172.28 1.05 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 118.914 1.357 . . . . 10.0 112.015 179.354 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.281 77.5 m-85 71.38 68.25 0.16 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.395 1.878 . . . . 10.0 111.614 -163.972 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.2 -23.45 5.19 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 126.731 2.11 . . . . 10.0 113.215 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mtp85 -77.68 162.51 26.95 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.401 1.096 . . . . 10.0 112.557 173.715 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HD2' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -73.75 179.02 4.42 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.459 2.304 . . . . 10.0 111.765 171.74 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.3 p -73.82 174.87 7.86 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.295 1.038 . . . . 10.0 109.439 161.294 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.39 -179.37 37.52 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-O 121.788 0.66 . . . . 10.0 111.717 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 65.32 166.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.563 1.945 . . . . 10.0 114.696 -176.544 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 162.36 167.38 0.05 OUTLIER Pre-proline 0 CA--C 1.546 0.824 1 C-N-CA 133.216 4.607 . . . . 10.0 105.212 -169.222 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.77 -143.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.55 1.318 0 C-N-CA 122.538 2.159 . . . . 10.0 108.927 146.997 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.88 18.94 0.17 Allowed Glycine 0 CA--C 1.544 1.862 0 N-CA-C 117.447 1.739 . . . . 10.0 117.447 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -77.35 106.06 8.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.443 1.622 . . . . 10.0 110.893 175.695 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 m -65.61 138.64 58.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.13 1.372 . . . . 10.0 111.567 173.435 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.452 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.46 -178.94 6.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.519 1.528 . . . . 10.0 112.3 -175.126 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.3 p -71.78 164.35 26.15 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.203 0.601 . . . . 10.0 111.805 167.819 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -75.48 -111.24 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.236 -0.915 . . . . 10.0 109.847 163.928 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 35.81 -87.34 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 130.086 3.354 . . . . 10.0 115.051 168.883 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -45.82 -56.97 4.7 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.209 1.403 . . . . 10.0 112.738 170.428 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -63.5 -35.78 81.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.227 0.611 . . . . 10.0 111.27 -175.71 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.21 -43.76 85.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.643 2.377 . . . . 10.0 113.417 172.641 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -21.94 55.09 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.851 1.797 . . . . 10.0 115.851 -167.86 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.06 -7.54 63.08 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 116.24 1.256 . . . . 10.0 116.24 159.788 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.6 pp -56.77 141.71 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 118.61 1.205 . . . . 10.0 111.966 -177.081 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.8 m -67.83 117.9 10.34 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 121.641 -0.662 . . . . 10.0 110.013 -178.288 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -71.18 113.55 8.33 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 170.925 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.62 179.52 7.14 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 10.0 111.887 -168.642 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -69.74 42.91 0.05 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.279 1.831 . . . . 10.0 115.207 -172.649 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -160.23 -66.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.132 2.173 . . . . 10.0 108.254 -176.372 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.0 p -57.22 -38.24 73.45 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 126.594 1.958 . . . . 10.0 112.731 -179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.57 -23.25 56.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 10.0 113.035 176.772 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -51.91 30.63 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.151 1.341 . . . . 10.0 108.466 169.454 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.2 -43.72 98.43 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 123.431 0.457 . . . . 10.0 110.315 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.61 -57.88 10.83 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 118.304 -0.855 . . . . 10.0 111.931 175.298 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.76 -28.79 67.11 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 120.288 1.404 . . . . 10.0 113.645 -172.114 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -78.88 -19.58 51.58 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.521 1.304 . . . . 10.0 114.521 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.4 60.73 1.43 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.37 1.068 . . . . 10.0 110.856 -167.681 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.95 -58.85 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.519 2.146 . . . . 10.0 111.343 -168.142 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -70.63 38.2 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 129.034 2.934 . . . . 10.0 113.174 179.206 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.07 -49.52 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 128.391 2.676 . . . . 10.0 108.828 -169.391 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -62.18 -36.78 82.92 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.907 0.321 . . . . 10.0 111.539 174.684 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.82 154.59 73.01 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 126.163 1.785 . . . . 10.0 108.72 166.122 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.43 164.81 34.52 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 121.65 1.566 . . . . 10.0 110.425 165.592 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.32 66.84 2.33 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.184 -0.787 . . . . 10.0 114.208 168.356 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -129.49 -33.26 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.786 1.773 . . . . 10.0 115.786 172.68 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 62.78 -63.26 0.11 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 116.954 -1.498 . . . . 10.0 113.889 -170.5 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.1 ttt 10.27 91.29 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 129.715 3.206 . . . . 10.0 114.512 -173.098 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 19.9 mm -72.51 74.2 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 125.376 1.47 . . . . 10.0 110.895 -175.964 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -163.29 -49.46 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.615 1.566 . . . . 10.0 112.101 169.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.83 78.62 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.717 2.407 . . . . 10.0 115.576 172.876 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.62 -159.48 25.86 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.206 1.384 . . . . 10.0 112.916 -176.675 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.9 tt -153.84 -178.66 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.376 1.47 . . . . 10.0 109.812 157.046 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -76.36 -87.2 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.804 1.242 . . . . 10.0 114.003 -166.941 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -65.74 0.9 Allowed 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.669 1.577 . . . . 10.0 111.342 -176.107 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.6 pttt 174.57 -61.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.905 2.482 . . . . 10.0 111.721 176.574 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.4 m -59.46 -20.72 57.36 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 -173.209 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -56.3 -26.99 54.06 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.081 0.855 . . . . 10.0 112.529 168.485 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -50.07 75.21 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 125.025 1.33 . . . . 10.0 110.898 172.285 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -62.72 -48.36 79.58 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.052 1.341 . . . . 10.0 110.222 176.954 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -59.88 -48.62 80.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.516 1.126 . . . . 10.0 111.773 -172.644 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mp -54.99 -49.64 70.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.19 0.811 . . . . 10.0 113.19 173.371 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.2 mm -62.67 -45.76 98.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 123.264 0.625 . . . . 10.0 109.69 -178.024 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.88 -46.86 86.84 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.817 1.247 . . . . 10.0 112.236 174.698 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.12 -59.95 4.19 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.875 0.87 . . . . 10.0 111.273 173.988 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.24 -37.95 89.3 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -173.51 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -62.06 -24.45 67.1 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.04 0.936 . . . . 10.0 112.852 176.956 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.51 -59.06 2.49 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.517 1.527 . . . . 10.0 111.896 165.485 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.61 -32.52 63.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.63 1.572 . . . . 10.0 114.588 -171.361 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -54.61 -32.27 58.52 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 174.845 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -87.93 -20.3 26.11 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.171 1.388 . . . . 10.0 114.372 177.957 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 116.128 -1.892 . . . . 10.0 112.939 -140.714 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 110.063 -1.215 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.503 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.7 OUTLIER -134.03 96.17 3.58 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.231 1.413 . . . . 10.0 107.447 -152.579 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.9 p -49.49 -39.02 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.679 1.592 . . . . 10.0 113.853 -162.43 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 53.4 mp0 -71.13 -32.65 69.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.85 1.26 . . . . 10.0 113.987 178.843 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.3 mttt -75.68 -28.31 58.61 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 125.252 1.421 . . . . 10.0 111.436 174.53 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.61 -42.42 93.45 Favored Glycine 0 C--N 1.334 0.462 0 N-CA-C 109.951 -1.26 . . . . 10.0 109.951 -173.36 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -62.87 -41.52 99.42 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.85 0.685 . . . . 10.0 112.85 173.099 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -62.21 -54.86 34.84 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.812 1.645 . . . . 10.0 111.323 179.406 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 tp -69.23 -33.4 57.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 122.637 0.375 . . . . 10.0 111.577 -179.192 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -57.67 -49.7 75.61 Favored 'General case' 0 C--N 1.344 0.356 0 O-C-N 121.663 -0.648 . . . . 10.0 110.672 168.335 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.41 -15.52 10.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.054 -1.029 . . . . 10.0 113.72 178.567 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -92.69 -41.8 9.96 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.291 1.037 . . . . 10.0 112.644 -179.527 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -117.94 -11.12 10.29 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.749 1.389 . . . . 10.0 114.749 -171.442 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.4 m -122.64 -45.94 2.15 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.404 1.482 . . . . 10.0 111.239 -169.739 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.94 -16.4 42.07 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 175.289 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -20.62 10.42 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 129.996 3.318 . . . . 10.0 113.699 166.464 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.9 m -142.46 -15.29 0.75 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.763 2.025 . . . . 10.0 113.443 178.413 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -133.43 62.11 1.66 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.691 2.397 . . . . 10.0 109.854 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -64.42 114.93 4.64 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.597 -1.314 . . . . 10.0 109.943 -177.293 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LEU . 24.5 t -140.9 -49.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.675 1.19 . . . . 10.0 111.676 -160.791 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.12 -10.36 1.17 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.021 1.328 . . . . 10.0 113.912 -177.372 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -150.15 15.56 0.82 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.486 2.714 . . . . 10.0 110.437 -179.434 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.379 0 C-N-CA 127.501 2.477 . . . . 10.0 115.232 -174.902 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -152.38 169.46 31.58 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.213 1.387 . . . . 10.0 110.648 171.112 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -72.29 9.62 1.13 Allowed 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.983 3.122 . . . . 10.0 115.238 -169.468 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 47.14 162.1 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 129.566 3.146 . . . . 10.0 114.39 -149.408 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.459 ' HB2' HG21 ' A' ' 20' ' ' VAL . 3.6 mm? -80.43 76.08 7.26 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.117 -0.99 . . . . 10.0 108.395 170.956 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -65.6 -174.01 0.18 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.929 1.292 . . . . 10.0 110.814 166.273 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.22 119.79 2.07 Favored Glycine 0 CA--C 1.537 1.426 0 O-C-N 121.24 -0.913 . . . . 10.0 112.205 166.899 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.45 -165.34 1.49 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 129.636 3.175 . . . . 10.0 109.137 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.309 76.6 m-85 63.4 -17.38 0.06 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.313 3.045 . . . . 10.0 118.774 173.075 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -138.69 -25.7 0.31 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 127.092 2.282 . . . . 10.0 113.432 163.539 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.4 170.28 12.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.946 1.299 . . . . 10.0 113.159 177.742 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.18 161.79 17.86 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.962 -1.086 . . . . 10.0 113.395 177.318 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.5 m -77.79 144.09 37.41 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.699 1.6 . . . . 10.0 110.539 179.091 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.18 0.39 65.69 Favored Glycine 0 N--CA 1.472 1.098 0 N-CA-C 115.652 1.021 . . . . 10.0 115.652 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -71.19 49.28 0.14 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 127.208 2.203 . . . . 10.0 113.81 -179.289 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.26 137.24 71.91 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 128.169 2.588 . . . . 10.0 113.394 -178.263 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.63 46.55 1.89 Allowed 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 123.505 2.803 . . . . 10.0 112.758 173.189 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.55 80.39 1.18 Allowed Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.628 1.585 . . . . 10.0 114.732 173.478 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -153.07 125.69 8.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.539 1.135 . . . . 10.0 111.425 173.16 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -79.93 87.78 5.34 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.851 1.261 . . . . 10.0 111.897 179.1 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.83 176.86 8.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.48 1.512 . . . . 10.0 112.513 166.25 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 49' ' ' THR . 0.3 OUTLIER -64.62 131.06 45.91 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.684 1.994 . . . . 10.0 109.898 158.766 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -75.13 -159.66 0.1 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.128 0.971 . . . . 10.0 111.67 172.329 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.38 -69.49 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.658 1.983 . . . . 10.0 113.524 -169.862 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.512 HD21 ' HA3' ' A' ' 77' ' ' GLY . 7.7 p30 -51.23 -51.36 54.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.383 1.873 . . . . 10.0 112.747 174.43 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HA ' ' HE2' ' A' ' 53' ' ' LYS . 1.8 mmpt? -72.1 -42.59 65.92 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.592 1.157 . . . . 10.0 113.107 170.584 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.6 -41.19 69.65 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.812 0.845 . . . . 10.0 112.75 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.85 -11.62 60.43 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.379 1.252 . . . . 10.0 114.379 176.889 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.97 9.02 55.77 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 118.182 2.033 . . . . 10.0 118.182 151.397 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.8 pp -40.64 10.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.236 2 C-N-CA 135.274 5.43 . . . . 10.0 121.893 -154.958 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.3 m 57.03 109.67 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 128.361 2.664 . . . . 10.0 114.646 -173.761 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -71.28 134.53 46.87 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.575 -1.193 . . . . 10.0 112.091 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -164.89 173.59 11.51 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 131.135 3.774 . . . . 10.0 105.595 173.12 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -57.6 -36.0 71.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 120.442 1.474 . . . . 10.0 114.036 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.97 -54.7 34.35 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.994 1.27 . . . . 10.0 111.165 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.8 p -65.77 -38.94 90.42 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.761 0.825 . . . . 10.0 111.928 -179.347 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.13 -27.61 59.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.497 1.044 . . . . 10.0 113.471 175.14 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 19.1 mtm -63.5 -53.45 51.82 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.154 1.343 . . . . 10.0 109.274 170.426 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -59.44 -45.82 90.49 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.916 0.76 . . . . 10.0 109.582 179.138 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -65.36 -48.35 73.27 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.59 -0.719 . . . . 10.0 112.762 -179.163 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.38 -29.45 67.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 120.849 1.659 . . . . 10.0 112.103 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -80.07 -22.82 41.84 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.727 1.38 . . . . 10.0 114.727 174.848 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.99 84.59 1.43 Allowed Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.218 1.407 . . . . 10.0 114.431 169.038 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.27 -49.03 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.364 2.043 . . . . 10.0 113.364 -165.637 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -71.66 -32.6 68.08 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.618 1.567 . . . . 10.0 111.519 -172.936 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -71.36 -41.84 69.22 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.603 1.161 . . . . 10.0 111.864 168.355 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -64.88 -48.92 72.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.18 0.9 . . . . 10.0 113.231 178.623 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 10.2 pt -128.75 102.39 19.79 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.688 0.795 . . . . 10.0 110.763 173.687 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.19 136.32 40.16 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.513 2.142 . . . . 10.0 110.752 -177.775 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.512 ' HA3' HD21 ' A' ' 52' ' ' ASN . . . 119.3 -32.39 5.09 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.581 1.562 . . . . 10.0 113.255 -178.217 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m -50.44 -24.79 3.32 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 118.784 2.883 . . . . 10.0 118.784 -165.609 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.404 ' HE3' ' N ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 58.29 -82.69 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 116.914 -1.517 . . . . 10.0 111.602 -162.174 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.2 ttt 31.25 95.47 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.398 2.679 . . . . 10.0 113.893 -169.026 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.7 mt -71.69 45.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 C-N-CA 126.772 2.029 . . . . 10.0 112.759 -175.6 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -163.45 86.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.245 2.218 . . . . 10.0 108.847 178.83 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.23 -13.73 62.3 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.138 1.532 . . . . 10.0 115.138 -170.784 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.3 165.12 31.52 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.655 1.121 . . . . 10.0 111.84 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.3 tt -95.08 170.36 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.061 1.345 . . . . 10.0 111.968 -178.199 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -45.68 -45.32 14.07 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.616 2.366 . . . . 10.0 114.604 -167.546 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -164.55 177.87 7.79 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.945 2.498 . . . . 10.0 108.661 168.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -64.36 -27.92 69.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.332 1.605 . . . . 10.0 115.332 -171.26 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.33 -49.95 74.48 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.935 1.698 . . . . 10.0 112.025 -179.824 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -76.66 -6.61 52.78 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.195 1.798 . . . . 10.0 114.569 172.236 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER -78.76 -36.1 43.56 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.634 -1.916 . . . . 10.0 112.502 156.591 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -69.16 -42.69 75.58 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.69 -1.256 . . . . 10.0 111.002 174.661 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.503 ' CB ' ' H ' ' A' ' 2' ' ' ASP 0.256 1.0 OUTLIER -60.68 -38.19 84.13 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.909 0.484 . . . . 10.0 112.217 -179.131 . . . . . . . . 4 4 . 1 . 029 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 mp -57.09 -47.84 80.05 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.581 1.952 . . . . 10.0 113.325 166.823 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.89 -49.69 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.306 0.957 . . . . 10.0 109.458 173.663 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.4 -46.48 86.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.129 0.972 . . . . 10.0 112.694 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.74 -61.71 2.39 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.094 1.357 . . . . 10.0 111.696 171.452 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.1 -28.24 69.31 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.355 -0.841 . . . . 10.0 112.897 -171.866 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.15 -16.31 63.86 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 172.044 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -107.38 -24.21 11.92 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 167.773 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.37 60.46 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.068 1.136 . . . . 10.0 114.068 -177.718 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.1 p -86.92 -4.74 59.21 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.085 1.354 . . . . 10.0 113.668 175.627 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -153.45 -7.42 0.17 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 116.264 1.95 . . . . 10.0 116.264 -165.648 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.972 -1.966 . . . . 10.0 114.088 166.549 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 CA-C-O 118.861 -0.966 . . . . 10.0 111.333 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.29 155.61 49.9 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -150.031 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 89.5 t -55.93 -52.87 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 125.25 1.42 . . . . 10.0 110.553 177.042 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.404 ' HA ' ' CE ' ' A' ' 7' ' ' LYS . 4.2 mp0 -53.38 -53.85 45.13 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.036 1.734 . . . . 10.0 113.691 179.172 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -55.57 -36.43 66.83 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.201 0.6 . . . . 10.0 110.828 173.321 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.53 -53.11 8.91 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.414 -1.074 . . . . 10.0 110.414 -172.088 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.404 ' CE ' ' HA ' ' A' ' 4' ' ' GLU . 31.9 pttt -57.54 -46.21 84.14 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.533 1.166 . . . . 10.0 112.466 -179.766 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -67.98 -46.23 71.93 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.601 0.76 . . . . 10.0 112.586 -178.682 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.1 mm -65.7 -35.55 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 118.733 0.697 . . . . 10.0 111.252 175.134 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -61.22 -53.6 54.81 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.99 0.814 . . . . 10.0 111.293 172.799 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.5 t -62.92 -11.63 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.341 -0.849 . . . . 10.0 112.81 -178.984 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -93.38 -59.27 2.06 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.76 1.624 . . . . 10.0 110.908 174.922 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -95.75 -12.35 25.53 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.738 1.385 . . . . 10.0 114.738 -168.987 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -123.73 -43.68 2.12 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.932 1.293 . . . . 10.0 111.732 -167.788 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.52 -7.73 5.11 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 167.093 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -16.44 12.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.766 2.027 . . . . 10.0 113.463 163.305 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.1 m -143.34 -27.48 0.56 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.204 1.802 . . . . 10.0 114.053 179.007 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -107.49 -161.68 0.79 Allowed 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 128.916 2.887 . . . . 10.0 111.309 -178.688 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -151.3 -61.79 0.18 Allowed 'General case' 0 N--CA 1.483 1.2 0 O-C-N 119.639 -1.913 . . . . 10.0 113.765 152.714 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.444 ' HB ' ' H ' ' A' ' 32' ' ' LEU 0.277 5.1 p 51.51 -48.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 130.219 3.408 . . . . 10.0 117.786 -175.477 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.15 128.26 34.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.122 1.328 . . . . 10.0 108.02 168.814 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.5 pttt 45.71 30.64 0.85 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.561 1.544 . . . . 10.0 113.842 -169.033 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.885 0 C-N-CA 126.871 2.177 . . . . 10.0 112.515 179.779 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.473 0.718 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.961 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -118.28 164.53 12.84 Favored Glycine 0 CA--C 1.538 1.517 0 N-CA-C 109.373 -1.491 . . . . 10.0 109.373 157.327 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -70.42 167.25 25.85 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.879 2.386 . . . . 10.0 111.413 -178.691 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -64.89 136.9 57.37 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.027 -1.471 . . . . 10.0 107.027 158.552 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.444 ' H ' ' HB ' ' A' ' 20' ' ' VAL . 2.8 mm? -79.04 66.93 4.61 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.199 -0.938 . . . . 10.0 109.274 -178.713 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.543 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -52.36 91.29 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 129.276 3.03 . . . . 10.0 111.592 -168.928 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 65.45 -70.26 0.1 OUTLIER Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.286 1.422 . . . . 10.0 111.907 -164.425 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.519 HD12 ' NH1' ' A' ' 38' ' ' ARG . 0.7 OUTLIER 65.75 -176.33 0.18 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 127.125 2.17 . . . . 10.0 110.411 -168.574 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 55.83 83.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.476 1.51 . . . . 10.0 113.758 179.277 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.3 -7.05 23.01 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.023 2.725 . . . . 10.0 113.638 -177.436 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.543 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 15.8 ttp180 -86.94 -139.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.099 2.16 . . . . 10.0 114.154 -171.719 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -153.39 162.96 40.75 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.995 2.518 . . . . 10.0 111.073 -177.704 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 55.0 p -67.21 -59.89 3.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.739 1.216 . . . . 10.0 111.38 178.135 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.04 75.11 0.48 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 125.879 1.704 . . . . 10.0 113.835 -178.427 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -0.34 3.88 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.573 1.694 . . . . 10.0 115.573 175.002 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -52.52 134.45 44.12 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.19 1.396 . . . . 10.0 113.356 -176.689 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -82.45 -107.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.749 2.966 . . . . 10.0 111.053 179.549 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.05 48.38 3.02 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.341 -1.474 . . . . 10.0 112.993 178.508 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -151.7 163.56 38.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.375 1.559 . . . . 10.0 111.997 -177.113 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -154.84 111.37 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.664 1.585 . . . . 10.0 107.03 166.773 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -82.17 -43.22 17.99 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.457 1.503 . . . . 10.0 110.658 -176.934 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.2 p -156.99 -153.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 129.473 3.109 . . . . 10.0 107.773 177.54 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -159.86 -171.01 3.08 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.901 1.68 . . . . 10.0 108.226 157.618 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 64.55 -32.14 0.13 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.188 2.195 . . . . 10.0 113.759 -157.772 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -75.37 -42.69 53.4 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 121.975 2.17 . . . . 10.0 113.694 166.651 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -50.89 -51.22 53.94 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.114 -0.991 . . . . 10.0 111.383 172.294 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -66.13 -16.25 63.8 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.555 1.687 . . . . 10.0 115.555 172.03 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.46 -17.21 59.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.28 1.4 . . . . 10.0 114.224 -179.848 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.82 -44.38 2.05 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.336 -1.813 . . . . 10.0 116.6 170.781 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -31.96 3.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.736 2 C-N-CA 133.915 4.886 . . . . 10.0 122.766 -135.232 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 38.3 m 56.21 104.13 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 128.024 2.53 . . . . 10.0 114.889 -177.29 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -58.31 140.87 52.61 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 113.559 -1.655 . . . . 10.0 110.94 159.909 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -175.42 -43.29 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.297 1.439 . . . . 10.0 113.763 -165.22 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.253 13.6 pt-20 163.29 -62.36 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 130.0 3.32 . . . . 10.0 111.715 165.558 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -46.22 -45.21 16.82 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.39 1.476 . . . . 10.0 112.538 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.8 p -68.63 -31.43 70.58 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 125.02 1.328 . . . . 10.0 112.535 178.115 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -75.43 -33.25 60.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.114 1.324 . . . . 10.0 112.591 168.991 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.7 mtm -57.31 -53.45 58.02 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.48 1.112 . . . . 10.0 109.235 175.26 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -67.74 -41.4 83.46 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 123.917 0.761 . . . . 10.0 110.622 178.608 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.66 -53.7 25.66 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.787 0.662 . . . . 10.0 112.787 -175.867 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -60.27 -42.79 96.14 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.957 1.253 . . . . 10.0 110.934 179.041 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -72.06 -23.84 61.43 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 114.599 1.333 . . . . 10.0 114.599 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 61.65 1.59 Allowed Pre-proline 0 CA--C 1.564 1.491 0 C-N-CA 125.007 1.323 . . . . 10.0 111.088 -167.294 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.63 -62.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.359 2.706 . . . . 10.0 113.835 -162.106 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -61.58 -26.49 68.0 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.177 1.391 . . . . 10.0 113.613 -178.65 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -71.81 -51.53 22.07 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.015 0.926 . . . . 10.0 110.22 170.854 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -60.76 -47.75 84.9 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.447 0.536 . . . . 10.0 112.447 -177.58 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.85 108.09 9.05 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.319 1.047 . . . . 10.0 109.7 174.947 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.55 153.46 60.28 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 122.03 1.82 . . . . 10.0 110.616 172.704 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.74 46.43 4.56 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-O 118.956 -0.913 . . . . 10.0 111.922 -170.674 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -138.44 -39.03 0.53 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 116.051 1.871 . . . . 10.0 116.051 -165.911 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt 60.27 -65.74 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 -171.279 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.7 ttt 20.46 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 130.059 3.344 . . . . 10.0 113.063 -171.193 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 81' ' ' ILE . 4.0 mp -69.5 74.25 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 126.423 1.889 . . . . 10.0 110.054 -175.432 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -163.51 -40.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.8 1.64 . . . . 10.0 112.605 178.648 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.57 82.6 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.025 2.53 . . . . 10.0 115.253 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.63 -161.37 16.88 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.942 1.258 . . . . 10.0 111.445 -169.217 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.6 tt -143.33 30.37 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.637 1.175 . . . . 10.0 110.435 170.975 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttt 69.35 0.59 2.94 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.459 2.304 . . . . 10.0 113.993 -175.77 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -162.61 173.49 13.86 Favored 'General case' 0 CA--C 1.542 0.649 1 C-N-CA 132.551 4.341 . . . . 10.0 106.979 -176.771 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -77.47 -52.06 9.72 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 155.62 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 m -43.65 -50.62 7.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.377 1.871 . . . . 10.0 113.054 -155.259 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -65.52 -24.47 67.13 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.652 0.781 . . . . 10.0 112.269 -173.347 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.474 HH21 HD12 ' A' ' 95' ' ' ILE 0.373 0.0 OUTLIER -76.18 -13.0 60.19 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.328 0.967 . . . . 10.0 113.441 172.498 . . . . . . . . 4 4 . 1 . 030 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -67.31 -52.64 37.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.857 0.863 . . . . 10.0 109.979 161.179 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -57.61 -44.28 85.34 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.52 1.528 . . . . 10.0 112.828 177.752 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.88 90.13 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.991 0.737 . . . . 10.0 112.991 174.303 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.474 HD12 HH21 ' A' ' 91' ' ' ARG . 14.3 mt -62.18 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 119.035 -0.507 . . . . 10.0 110.538 173.583 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.31 75.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.43 0.692 . . . . 10.0 111.916 175.307 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.2 -57.51 12.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.813 1.645 . . . . 10.0 112.946 173.062 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -66.72 -29.12 69.03 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.657 1.117 . . . . 10.0 113.22 -175.019 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -59.27 -26.95 65.37 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.841 0.856 . . . . 10.0 112.919 168.989 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -85.56 -53.23 5.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 117.821 -1.085 . . . . 10.0 112.009 165.644 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.37 -15.74 39.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.967 1.84 . . . . 10.0 115.967 -171.662 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.3 t -68.46 -2.78 9.42 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.133 1.161 . . . . 10.0 114.133 165.477 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -151.2 -23.6 0.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.225 1.81 . . . . 10.0 114.071 -176.218 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.7 2.0 . . . . 10.0 110.921 179.639 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 CA-C-O 118.735 -1.036 . . . . 10.0 110.708 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -133.76 161.38 34.86 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.256 1.206 . . . . 10.0 114.256 -152.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.7 m -68.35 -41.49 83.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 122.709 0.403 . . . . 10.0 111.977 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 mp0 -60.76 -49.26 78.22 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.843 1.257 . . . . 10.0 110.26 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.442 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 8.8 mmpt? -62.71 -14.77 47.99 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.687 1.195 . . . . 10.0 113.095 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -104.79 -45.34 1.41 Allowed Glycine 0 C--N 1.339 0.704 0 CA-C-N 119.703 1.138 . . . . 10.0 112.46 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -34.69 72.3 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.709 1.754 . . . . 10.0 112.443 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -62.19 -28.67 69.83 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.832 1.253 . . . . 10.0 114.259 177.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -98.42 -32.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.139 0.976 . . . . 10.0 110.684 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.478 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 t80 -57.82 -54.32 48.25 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 121.823 -0.548 . . . . 10.0 110.935 169.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.5 t -66.01 -11.62 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -90.25 -56.04 3.37 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.721 1.208 . . . . 10.0 111.325 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -125.59 7.76 7.6 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 116.238 1.94 . . . . 10.0 116.238 -168.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 33.7 m -110.76 -49.01 3.07 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.295 1.038 . . . . 10.0 110.648 166.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.53 53.07 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.919 1.081 . . . . 10.0 113.919 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -13.77 39.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.827 2.451 . . . . 10.0 113.564 169.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.6 m -141.15 -33.64 0.52 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.229 1.812 . . . . 10.0 112.237 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -120.19 66.6 0.83 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 128.954 2.902 . . . . 10.0 109.922 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -68.19 127.49 33.11 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.356 -1.465 . . . . 10.0 108.178 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.42 -66.39 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 124.632 1.173 . . . . 10.0 110.595 -176.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.53 -31.32 65.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.184 0.902 . . . . 10.0 112.698 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.17 -6.23 59.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.55 1.14 . . . . 10.0 113.785 178.855 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.33 126.5 3.39 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 126.596 2.046 . . . . 10.0 110.871 -163.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -46.15 127.54 9.56 Favored Glycine 0 CA--C 1.538 1.497 0 C-N-CA 125.97 1.747 . . . . 10.0 114.835 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.43 97.76 1.0 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.213 1.805 . . . . 10.0 111.432 169.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.574 ' HB3' ' H ' ' A' ' 31' ' ' ASN . 16.6 p80 -72.29 57.43 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.759 1.623 . . . . 10.0 112.492 170.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.9 pttt -83.14 -17.58 42.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.761 1.393 . . . . 10.0 114.761 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.4 m -154.3 -10.42 0.14 Allowed 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.056 -1.027 . . . . 10.0 113.398 170.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.66 167.35 24.83 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 157.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.02 127.9 16.8 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.854 2.369 . . . . 10.0 110.805 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.574 ' H ' ' HB3' ' A' ' 26' ' ' HIS . 0.3 OUTLIER -63.99 127.61 32.19 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.224 -0.923 . . . . 10.0 110.45 -178.899 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.7 81.5 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.858 1.263 . . . . 10.0 111.862 -170.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.68 73.14 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.111 2.164 . . . . 10.0 109.962 163.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.78 -63.08 0.32 Allowed Glycine 0 CA--C 1.535 1.312 0 C-N-CA 127.718 2.58 . . . . 10.0 114.065 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.473 ' CD2' HMA3 ' A' ' 105' ' ' HEC . 1.0 OUTLIER 68.29 -48.6 0.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.449 2.7 . . . . 10.0 116.022 -178.164 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.715 ' HB2' HG21 ' A' ' 102' ' ' THR . 41.8 m-85 -63.67 113.44 3.36 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.595 1.089 . . . . 10.0 111.095 -174.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.48 0.0 82.37 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.954 1.264 . . . . 10.0 113.947 -175.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.8 mtp85 -86.89 -127.93 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.901 1.281 . . . . 10.0 110.802 172.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -154.35 173.41 16.23 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.188 1.795 . . . . 10.0 110.99 -172.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 t -95.8 -48.16 5.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.967 0.907 . . . . 10.0 113.344 -174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.05 61.66 2.99 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.528 1.537 . . . . 10.0 111.609 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -130.15 -18.96 3.23 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.088 1.755 . . . . 10.0 113.347 -161.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.32 151.74 86.5 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 124.464 1.105 . . . . 10.0 112.572 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -76.01 -160.19 0.11 Allowed 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 124.277 3.318 . . . . 10.0 110.839 167.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.23 86.96 0.01 OUTLIER Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.715 2.103 . . . . 10.0 115.327 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -144.05 -179.43 6.49 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.329 2.252 . . . . 10.0 109.559 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.6 m -156.86 142.9 17.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 119.741 -1.849 . . . . 10.0 109.774 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.55 -85.72 0.06 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.886 0.874 . . . . 10.0 112.806 -163.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 t -144.93 173.85 11.52 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.639 2.776 . . . . 10.0 108.751 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.05 -37.33 58.42 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.953 -1.092 . . . . 10.0 112.322 155.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.1 -61.82 1.99 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.022 1.329 . . . . 10.0 112.776 -160.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -51.71 -61.82 2.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.963 0.905 . . . . 10.0 111.906 -171.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -56.08 26.79 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.418 1.087 . . . . 10.0 111.847 -176.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -44.2 82.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.176 -0.916 . . . . 10.0 111.737 -171.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.59 -45.25 38.7 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.171 -0.919 . . . . 10.0 111.708 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 55.37 -179.24 0.33 Allowed Glycine 0 CA--C 1.54 1.621 0 N-CA-C 116.696 1.438 . . . . 10.0 116.696 -176.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.66 -6.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 128.328 2.651 . . . . 10.0 113.701 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.0 m 55.84 115.95 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.846 2.059 . . . . 10.0 113.038 -159.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -73.09 126.3 29.67 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.295 -0.878 . . . . 10.0 111.658 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -165.34 176.03 8.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.272 2.229 . . . . 10.0 110.184 -174.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.32 -30.06 64.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.248 1.419 . . . . 10.0 114.33 -176.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -71.96 -71.65 0.27 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.853 0.861 . . . . 10.0 110.746 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.5 p -59.61 -38.15 80.49 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 125.88 1.672 . . . . 10.0 112.844 -165.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.28 -29.44 60.11 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.289 0.949 . . . . 10.0 113.134 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 ttm -69.6 -48.75 59.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 171.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -57.29 -45.0 84.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.275 1.43 . . . . 10.0 110.546 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.415 ' HE1' HG21 ' A' ' 78' ' ' THR . 73.1 t80 -61.48 -60.04 4.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.619 1.568 . . . . 10.0 112.945 172.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -56.63 -32.23 65.12 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.783 1.629 . . . . 10.0 114.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.21 -24.61 63.13 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.909 1.448 . . . . 10.0 114.909 174.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -163.3 91.71 1.17 Allowed Pre-proline 0 CA--C 1.552 1.035 0 CA-C-N 119.759 1.163 . . . . 10.0 112.602 162.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.98 -37.99 2.48 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.406 2.071 . . . . 10.0 112.544 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -59.06 -43.12 91.69 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.878 1.671 . . . . 10.0 112.444 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -75.0 -41.06 60.24 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 118.982 -0.532 . . . . 10.0 111.434 175.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -69.04 -36.72 78.03 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.821 1.415 . . . . 10.0 114.821 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -131.18 127.82 21.99 Favored Pre-proline 0 N--CA 1.475 0.788 0 CA-C-N 119.169 0.895 . . . . 10.0 111.035 172.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.15 93.8 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.912 3.075 . . . . 10.0 113.315 -153.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 110.97 0.0 28.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.574 1.083 . . . . 10.0 114.299 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.497 HG23 ' CGD' ' A' ' 105' ' ' HEC . 12.5 m -60.15 106.58 0.53 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.68 1.24 . . . . 10.0 111.206 172.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -64.36 -56.67 12.8 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.211 -0.9 . . . . 10.0 112.157 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.0 ttt 25.31 84.2 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.814 2.445 . . . . 10.0 114.115 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 30.8 mt -73.57 77.33 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.937 1.295 . . . . 10.0 110.829 -172.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -163.34 -45.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.15 1.78 . . . . 10.0 111.62 170.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.58 0.96 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 120.743 3.608 . . . . 10.0 120.743 172.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.72 170.71 40.65 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 125.516 1.531 . . . . 10.0 111.176 169.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -143.18 63.12 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 118.809 1.305 . . . . 10.0 112.861 -164.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 62.29 -56.87 0.14 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 128.22 2.608 . . . . 10.0 116.096 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -163.47 156.25 18.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.6 2.36 . . . . 10.0 109.096 -169.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -7.7 11.79 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 10.0 115.301 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -54.1 8.8 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.446 1.499 . . . . 10.0 110.751 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -54.28 -35.3 62.42 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.306 1.042 . . . . 10.0 110.95 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -56.8 -65.19 0.66 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.583 1.953 . . . . 10.0 112.107 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -31.56 72.47 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.997 0.74 . . . . 10.0 112.997 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -57.55 -47.42 82.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.692 0.797 . . . . 10.0 110.61 170.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.82 -46.43 84.7 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 175.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.1 mm -56.48 -52.53 51.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.82 60.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 117.64 -1.171 . . . . 10.0 113.669 -174.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.4 -64.87 0.76 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.374 1.869 . . . . 10.0 110.805 162.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.6 mt -60.17 -30.28 69.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.278 0.631 . . . . 10.0 112.684 -174.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -59.3 -21.93 60.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.872 1.064 . . . . 10.0 113.872 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -79.27 -45.19 20.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.694 -1.146 . . . . 10.0 110.809 168.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.19 1.28 0.19 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.304 1.594 . . . . 10.0 115.304 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.715 HG21 ' HB2' ' A' ' 36' ' ' PHE . 9.6 p -110.37 11.84 23.21 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.859 1.663 . . . . 10.0 114.348 168.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -153.57 -34.59 0.11 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.534 1.061 . . . . 10.0 113.815 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 . . . . . 0 C--O 1.259 1.563 0 C-N-CA 125.161 1.385 . . . . 10.0 110.9 149.669 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.497 ' CGD' HG23 ' A' ' 78' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.896 0 CA-C-O 118.416 -1.213 . . . . 10.0 111.007 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -109.21 145.51 35.74 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.905 0.852 . . . . 10.0 112.467 -167.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.12 -41.43 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 118.413 -0.803 . . . . 10.0 112.005 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -51.79 -57.03 10.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.911 1.284 . . . . 10.0 112.611 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -57.06 -25.5 58.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.006 1.323 . . . . 10.0 111.722 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -86.94 -50.37 3.73 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.406 1.479 . . . . 10.0 111.841 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.5 pttp -63.13 -43.21 99.01 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.76 1.28 . . . . 10.0 111.57 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -40.83 97.7 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.054 -0.974 . . . . 10.0 111.728 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.85 -25.29 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 119.384 0.993 . . . . 10.0 112.774 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -55.96 -50.75 69.94 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.249 -0.907 . . . . 10.0 109.681 163.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.04 29.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 N-CA-C 113.415 0.894 . . . . 10.0 113.415 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -36.57 5.36 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 119.265 -2.147 . . . . 10.0 112.272 164.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.99 -55.59 1.37 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.631 0.772 . . . . 10.0 112.921 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -52.15 -49.49 63.66 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 125.256 1.422 . . . . 10.0 112.802 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.7 -22.87 62.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.925 1.083 . . . . 10.0 113.925 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -16.16 51.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.92 0.888 . . . . 10.0 112.356 173.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 82.1 m -141.34 0.51 1.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.864 1.266 . . . . 10.0 114.228 -174.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 97.1 m-70 -150.47 12.17 0.71 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.593 1.331 . . . . 10.0 114.593 -172.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 t -42.76 104.9 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.7 1.741 . . . . 10.0 115.7 -165.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.8 p -142.29 -8.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 127.339 2.256 . . . . 10.0 112.559 -171.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.73 -18.82 13.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.124 1.369 . . . . 10.0 112.033 165.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -152.76 145.98 24.72 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.395 1.478 . . . . 10.0 110.981 155.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 -59.1 2.27 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.354 1.454 . . . . 10.0 115.559 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.87 120.69 1.79 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 124.527 1.06 . . . . 10.0 112.231 -169.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.22 150.3 18.21 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 128.244 2.618 . . . . 10.0 108.841 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -81.57 -96.81 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.571 1.148 . . . . 10.0 111.548 -175.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 mttm 56.33 106.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 128.506 2.723 . . . . 10.0 112.73 -169.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.2 m 57.85 -31.42 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.612 2.365 . . . . 10.0 116.676 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.57 168.86 14.98 Favored Glycine 0 CA--C 1.543 1.807 0 CA-C-N 120.582 1.537 . . . . 10.0 112.918 171.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 20.9 Cg_endo -71.55 -8.09 22.54 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 124.691 3.594 . . . . 10.0 118.61 -167.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.57 142.16 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.741 1.616 . . . . 10.0 113.87 -154.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -85.51 70.39 10.76 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.052 -1.03 . . . . 10.0 110.157 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.27 114.53 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.316 1.446 . . . . 10.0 110.17 165.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 9.14 76.36 0.01 OUTLIER Glycine 0 N--CA 1.476 1.308 0 C-N-CA 129.044 3.212 . . . . 10.0 115.9 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD21 HMA3 ' A' ' 105' ' ' HEC . 0.5 OUTLIER -72.06 -30.6 65.3 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 116.189 1.922 . . . . 10.0 116.189 -156.337 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -85.87 93.67 8.97 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.965 0.802 . . . . 10.0 111.607 -159.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.08 -13.91 6.31 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 127.051 2.262 . . . . 10.0 114.282 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -85.81 157.98 20.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.733 1.266 . . . . 10.0 113.416 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -77.01 169.76 17.75 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.659 1.184 . . . . 10.0 112.023 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.2 t -50.91 155.54 1.17 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.065 2.146 . . . . 10.0 115.927 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 59.11 31.06 68.11 Favored Glycine 0 CA--C 1.539 1.546 0 N-CA-C 118.458 2.143 . . . . 10.0 118.458 155.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -83.59 7.0 18.62 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 120.241 2.021 . . . . 10.0 115.363 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 133.91 93.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.623 1.102 . . . . 10.0 112.72 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.12 87.38 0.73 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.646 2.23 . . . . 10.0 113.041 -172.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.13 -1.7 88.5 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.947 1.736 . . . . 10.0 115.823 167.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -66.39 137.08 56.62 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.754 1.277 . . . . 10.0 112.067 176.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 m -72.61 83.08 1.13 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.716 1.607 . . . . 10.0 112.652 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.28 175.33 9.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.639 1.176 . . . . 10.0 112.917 168.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.1 p -76.68 -175.36 3.36 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.695 1.598 . . . . 10.0 113.572 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -66.79 177.09 1.75 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.208 1.403 . . . . 10.0 113.23 152.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.67 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 129.352 3.061 . . . . 10.0 116.029 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.573 HD22 ' CGD' ' A' ' 105' ' ' HEC . 8.6 t30 -47.61 -59.93 2.91 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.891 1.678 . . . . 10.0 112.286 -170.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -27.0 68.97 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.545 -0.722 . . . . 10.0 112.482 -176.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -26.8 63.86 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 117.209 2.3 . . . . 10.0 117.209 171.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -163.29 -1.31 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 116.648 2.092 . . . . 10.0 116.648 -155.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -67.85 163.34 47.47 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.63 1.586 . . . . 10.0 114.107 -177.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -66.31 173.89 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.89 2.476 . . . . 10.0 114.206 -176.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 m -69.57 124.33 23.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.024 0.93 . . . . 10.0 110.232 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -75.38 124.64 27.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.578 0.751 . . . . 10.0 111.716 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.8 pttt -171.3 -176.73 1.95 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.562 2.345 . . . . 10.0 109.5 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.33 -55.07 5.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.901 0.88 . . . . 10.0 112.299 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.21 12.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.948 2.499 . . . . 10.0 115.783 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 63.5 p -157.67 -34.8 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.246 1.018 . . . . 10.0 111.356 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -33.27 60.69 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.807 1.185 . . . . 10.0 112.761 169.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 70.3 mtm -66.28 -48.15 71.35 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.979 1.263 . . . . 10.0 110.521 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -63.89 -37.79 88.71 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 122.652 0.381 . . . . 10.0 110.397 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -65.01 -60.63 2.83 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-O 119.035 -0.507 . . . . 10.0 111.927 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -29.92 70.31 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 120.196 1.362 . . . . 10.0 112.444 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -69.08 -31.24 69.84 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 170.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.84 76.79 1.67 Allowed Pre-proline 0 CA--C 1.553 1.078 0 CA-C-N 120.035 1.289 . . . . 10.0 113.163 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.01 -44.23 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.928 1.752 . . . . 10.0 111.942 -159.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -68.03 -30.65 69.93 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 126.427 1.891 . . . . 10.0 112.7 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -76.26 -40.24 52.36 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.737 1.215 . . . . 10.0 112.352 168.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -63.97 -45.88 87.1 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.748 0.704 . . . . 10.0 112.45 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.99 129.39 10.52 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.796 1.638 . . . . 10.0 110.414 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.62 179.42 4.7 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.806 2.337 . . . . 10.0 112.656 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.2 -33.87 1.1 Allowed Glycine 0 CA--C 1.529 0.943 0 C-N-CA 126.216 1.865 . . . . 10.0 114.156 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 90.3 m -60.56 83.26 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.997 1.719 . . . . 10.0 113.957 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.22 31.96 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.477 2.711 . . . . 10.0 114.123 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.7 ttt -64.39 108.78 1.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.058 1.743 . . . . 10.0 111.219 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 mt -76.5 67.33 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.856 1.262 . . . . 10.0 110.481 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -163.43 -35.9 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.693 1.368 . . . . 10.0 114.693 172.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.22 -3.96 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 121.154 3.761 . . . . 10.0 121.154 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.83 -147.72 5.08 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-N 120.868 1.667 . . . . 10.0 112.148 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tt -144.48 171.86 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.937 0.895 . . . . 10.0 108.89 158.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -75.01 -7.31 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.618 1.34 . . . . 10.0 114.618 -160.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.59 -67.37 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.882 1.273 . . . . 10.0 110.666 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.38 -53.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 127.577 2.351 . . . . 10.0 112.634 162.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.7 m -50.92 -33.62 25.07 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.357 1.863 . . . . 10.0 112.118 -168.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -45.15 -50.09 11.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.254 1.422 . . . . 10.0 112.202 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.353 0.0 OUTLIER -77.76 -10.84 59.75 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.112 1.523 . . . . 10.0 115.112 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -75.02 -40.72 60.36 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.163 0.892 . . . . 10.0 110.488 162.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.22 -40.28 78.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.417 1.087 . . . . 10.0 112.092 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.534 HD21 HMB1 ' A' ' 105' ' ' HEC . 15.9 tp -57.84 -46.23 85.08 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.579 1.552 . . . . 10.0 113.122 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 mm -59.07 -46.42 91.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 C-N-CA 124.176 0.99 . . . . 10.0 109.786 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -43.36 98.75 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.146 0.43 . . . . 10.0 111.931 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.6 -56.64 19.6 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.824 0.85 . . . . 10.0 111.974 170.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.15 -26.55 68.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.778 1.172 . . . . 10.0 112.955 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.01 -12.2 7.54 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.402 1.481 . . . . 10.0 113.382 167.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -131.62 36.04 3.77 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.206 3.002 . . . . 10.0 111.979 166.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.72 30.69 4.34 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.4 1.48 . . . . 10.0 110.052 154.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -142.36 7.73 1.76 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.895 2.078 . . . . 10.0 115.112 -174.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -153.05 -73.24 0.14 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.454 2.302 . . . . 10.0 108.242 177.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.258 1.529 0 CA-C-O 117.133 -1.413 . . . . 10.0 109.083 124.222 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.573 ' CGD' HD22 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.96 0 CA-C-O 119.112 -0.826 . . . . 10.0 111.407 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.401 ' HB3' ' H ' ' A' ' 4' ' ' GLU . 57.8 m-20 -93.99 -173.16 3.04 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.399 1.88 . . . . 10.0 110.853 176.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.0 t -78.78 -32.9 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 120.312 -1.492 . . . . 10.0 111.166 143.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' H ' ' HB3' ' A' ' 2' ' ' ASP . 0.6 OUTLIER -68.15 -36.08 79.1 Favored 'General case' 0 CA--C 1.514 -0.425 0 C-N-CA 128.063 2.545 . . . . 10.0 114.224 -159.653 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -73.36 -25.47 60.61 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.44 -54.5 5.51 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 126.167 1.842 . . . . 10.0 110.289 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -23.39 67.4 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.485 1.291 . . . . 10.0 114.485 178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -76.49 -53.49 8.03 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 120.143 1.338 . . . . 10.0 113.414 164.283 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.32 -31.33 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.438 1.017 . . . . 10.0 112.555 -170.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.56 -51.31 69.06 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.175 0.443 . . . . 10.0 109.999 172.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.2 -9.1 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 112.868 0.692 . . . . 10.0 112.868 -177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -96.11 -47.68 5.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.374 1.47 . . . . 10.0 111.562 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -119.62 -8.53 9.94 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.428 1.64 . . . . 10.0 115.428 -170.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 34.5 m -113.92 -45.16 3.1 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.813 1.245 . . . . 10.0 111.325 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.21 -25.04 61.13 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 176.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.05 -14.39 0.41 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.415 2.686 . . . . 10.0 114.096 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -141.23 -34.7 0.48 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.609 1.564 . . . . 10.0 112.053 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -103.58 -9.68 19.05 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.949 1.463 . . . . 10.0 114.949 -173.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' H ' ' A' ' 20' ' ' VAL 0.359 6.8 t 38.58 -88.93 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.305 2.642 . . . . 10.0 115.694 -166.772 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 19' ' ' THR 0.3 8.7 p 37.48 48.51 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 128.965 2.906 . . . . 10.0 115.986 174.13 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.44 -41.11 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.274 1.03 . . . . 10.0 112.784 170.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -154.14 -40.99 0.09 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 130.431 3.492 . . . . 10.0 110.786 -173.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.45 136.04 13.24 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 127.064 2.269 . . . . 10.0 112.302 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.19 121.01 7.06 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.682 1.611 . . . . 10.0 112.173 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.416 ' HD3' ' H ' ' A' ' 26' ' ' HIS . 5.0 tmtt? -164.6 171.25 14.71 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.266 2.626 . . . . 10.0 108.068 -178.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.416 ' H ' ' HD3' ' A' ' 25' ' ' LYS . 2.2 p80 -154.47 115.46 4.02 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.407 1.483 . . . . 10.0 108.826 -174.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.46 124.3 13.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.089 0.556 . . . . 10.0 110.047 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.435 ' O ' HMD3 ' A' ' 105' ' ' HEC . 11.9 m 56.26 -19.77 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.763 2.025 . . . . 10.0 115.66 -166.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -133.72 163.82 24.42 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.564 2.031 . . . . 10.0 111.754 162.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.72 161.56 21.6 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.261 2.641 . . . . 10.0 112.075 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.546 HD21 ' CD2' ' A' ' 33' ' ' HIS . 8.9 p-10 -65.29 11.25 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 130.267 3.427 . . . . 10.0 115.944 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt 50.52 -33.25 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.952 1 C-N-CA 132.075 4.15 . . . . 10.0 118.181 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.546 ' CD2' HD21 ' A' ' 31' ' ' ASN 0.276 0.0 OUTLIER 34.5 72.58 0.09 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.631 3.172 . . . . 10.0 114.227 178.789 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.92 -34.49 0.74 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 126.288 1.899 . . . . 10.0 114.667 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tp 60.51 -68.08 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.814 3.246 . . . . 10.0 116.387 170.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -65.67 114.51 5.03 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.645 1.578 . . . . 10.0 110.82 -171.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.68 1.83 88.94 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 118.654 -1.081 . . . . 10.0 114.484 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.573 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.6 OUTLIER -78.81 -96.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.887 1.343 . . . . 10.0 108.469 169.557 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -156.64 175.18 14.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.752 2.421 . . . . 10.0 109.781 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.7 m -109.09 95.37 5.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.871 -1.9 . . . . 10.0 105.871 153.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.27 -66.3 0.09 OUTLIER Glycine 0 CA--C 1.528 0.858 0 CA-C-O 122.022 0.79 . . . . 10.0 113.069 -163.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -64.77 133.91 53.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.679 1.992 . . . . 10.0 113.514 -172.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.66 150.76 10.48 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 128.47 2.708 . . . . 10.0 107.317 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.57 66.27 8.55 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.734 2.956 . . . . 10.0 111.817 -176.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.86 71.59 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.295 0.95 . . . . 10.0 115.219 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.11 119.59 10.46 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.08 1.352 . . . . 10.0 111.204 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.0 m -70.92 82.98 0.66 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.291 1.837 . . . . 10.0 113.174 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -86.17 -173.25 4.47 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.795 1.638 . . . . 10.0 113.896 170.071 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.3 t -62.57 172.49 1.57 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 126.188 1.795 . . . . 10.0 111.581 168.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -75.47 -80.44 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 120.417 -1.427 . . . . 10.0 111.511 154.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 69.42 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 131.365 3.866 . . . . 10.0 116.498 -165.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -161.68 -70.89 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.363 2.265 . . . . 10.0 107.601 169.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.544 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -55.16 -37.44 66.99 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.11 2.564 . . . . 10.0 111.197 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.74 -37.6 84.82 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.54 1.136 . . . . 10.0 113.192 176.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -76.91 -50.09 14.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.076 0.853 . . . . 10.0 112.011 170.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.34 82.16 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.896 1.236 . . . . 10.0 113.394 -175.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.5 pp -66.23 -16.95 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.067 -1.255 . . . . 10.0 113.618 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.507 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 24.3 m 55.77 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 129.378 3.071 . . . . 10.0 113.393 -169.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.501 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 51.2 m95 -77.18 146.78 36.84 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 120.887 -1.133 . . . . 10.0 111.421 168.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 58' ' ' THR . 7.2 ptpt -163.64 -51.46 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.351 1.46 . . . . 10.0 110.939 -170.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 171.87 -55.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 130.338 3.455 . . . . 10.0 109.44 164.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -44.72 -54.9 5.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.148 2.179 . . . . 10.0 112.48 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 66.9 p -65.52 -28.25 69.04 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 125.213 1.405 . . . . 10.0 113.209 -173.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.507 HD22 HH12 ' A' ' 91' ' ' ARG . 0.3 OUTLIER -75.21 -28.5 59.99 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.375 1.07 . . . . 10.0 112.337 173.423 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.4 mtm -69.88 -47.5 62.37 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-O 118.738 -0.649 . . . . 10.0 110.793 172.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -61.83 -43.2 99.33 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.153 0.502 . . . . 10.0 110.438 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.482 ' HE1' HG21 ' A' ' 78' ' ' THR . 43.0 t80 -57.97 -67.41 0.34 Allowed 'General case' 0 C--O 1.221 -0.441 0 CA-C-O 117.553 -1.213 . . . . 10.0 111.924 176.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.483 ' HB2' HH11 ' A' ' 91' ' ' ARG . 5.4 mt -65.87 -19.55 65.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 121.439 1.927 . . . . 10.0 114.816 -173.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -73.75 -24.7 59.91 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.813 1.188 . . . . 10.0 113.881 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.78 64.84 1.55 Allowed Pre-proline 0 CA--C 1.559 1.311 0 CA-C-N 120.124 1.329 . . . . 10.0 112.999 -177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -72.32 -46.58 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.183 1.922 . . . . 10.0 113.014 -159.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -26.47 68.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.552 1.141 . . . . 10.0 112.697 176.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -76.16 -48.07 21.87 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.728 0.811 . . . . 10.0 111.291 169.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.65 -38.1 88.38 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.561 0.948 . . . . 10.0 113.561 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 pt -142.81 105.58 5.33 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.819 1.248 . . . . 10.0 109.644 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.16 -24.58 44.29 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.484 2.789 . . . . 10.0 115.321 -155.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.33 -9.53 81.7 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.586 -1.119 . . . . 10.0 114.385 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.482 HG21 ' HE1' ' A' ' 67' ' ' TYR . 86.1 m -76.88 75.75 3.48 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.916 1.858 . . . . 10.0 112.442 -172.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -68.97 27.11 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.714 2.006 . . . . 10.0 114.609 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.43 ' HA ' HMD2 ' A' ' 105' ' ' HEC . 48.8 ttp -50.67 117.68 2.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.31 2.244 . . . . 10.0 111.83 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.0 mt -76.48 68.3 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.511 1.524 . . . . 10.0 109.638 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -163.85 -32.28 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.466 1.506 . . . . 10.0 113.533 174.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.7 -24.06 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 120.145 3.387 . . . . 10.0 120.145 -173.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 173.02 167.2 32.6 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 122.131 2.242 . . . . 10.0 113.844 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 tt -93.32 160.71 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.868 0.867 . . . . 10.0 111.909 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.07 -31.49 65.26 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 116.024 1.861 . . . . 10.0 116.024 -167.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -164.34 148.61 9.68 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.724 1.61 . . . . 10.0 109.766 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -20.62 65.28 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.326 1.232 . . . . 10.0 114.326 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.0 m -59.26 -44.25 92.42 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.08 -1.013 . . . . 10.0 111.254 171.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.03 -35.83 82.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.297 1.439 . . . . 10.0 111.045 177.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.507 HH12 HD22 ' A' ' 64' ' ' LEU . 8.1 tpm_? -60.08 -47.94 83.78 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.316 1.446 . . . . 10.0 111.239 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -59.31 -51.32 70.43 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.626 0.77 . . . . 10.0 111.485 170.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -43.71 81.39 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.826 1.65 . . . . 10.0 112.683 -174.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.6 -37.88 73.97 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.35 -48.75 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 118.639 0.654 . . . . 10.0 109.441 173.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.04 -49.78 76.58 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.369 0.668 . . . . 10.0 112.038 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.05 -59.16 5.14 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.091 0.956 . . . . 10.0 111.91 172.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.45 -35.62 79.86 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.406 1.003 . . . . 10.0 112.201 -176.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.74 -15.93 63.3 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.462 1.028 . . . . 10.0 112.976 177.129 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -109.84 20.56 17.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.059 1.343 . . . . 10.0 114.248 165.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.56 -1.18 14.15 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.596 1.558 . . . . 10.0 112.561 164.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.47 -4.36 57.33 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.798 -1.189 . . . . 10.0 113.053 173.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -154.9 3.34 0.21 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.104 1.362 . . . . 10.0 113.973 -159.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 127.755 2.422 . . . . 10.0 107.809 -173.232 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.501 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 110.623 -0.991 . . . . 10.0 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -136.76 135.94 38.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.537 1.535 . . . . 10.0 109.198 -161.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.9 t -54.33 -49.95 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.94 0.896 . . . . 10.0 111.08 -172.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.96 -56.31 19.0 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.674 1.59 . . . . 10.0 112.976 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 32.5 mtmm -61.01 -24.87 66.49 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 112.875 0.695 . . . . 10.0 112.875 175.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.48 -50.58 6.53 Favored Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.042 -1.223 . . . . 10.0 110.042 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -63.32 -43.16 98.59 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 118.911 1.355 . . . . 10.0 113.274 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -62.36 -39.21 92.39 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.134 0.879 . . . . 10.0 112.75 179.777 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -79.29 -36.07 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.792 0.724 . . . . 10.0 111.719 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -56.21 -48.85 75.63 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.997 0.919 . . . . 10.0 110.683 171.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.61 -15.58 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 113.609 0.966 . . . . 10.0 113.609 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -96.08 -33.72 11.99 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 123.946 0.898 . . . . 10.0 113.42 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.9 1.84 2.8 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 116.109 1.892 . . . . 10.0 116.109 -172.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -122.12 -49.2 2.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.013 1.725 . . . . 10.0 110.851 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.72 66.71 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.545 0.943 . . . . 10.0 113.545 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -46.07 -47.92 17.05 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.911 1.684 . . . . 10.0 112.057 171.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 98.5 m -89.22 -44.39 10.31 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 10.0 113.408 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 88.9 m-70 -105.96 -10.02 16.8 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.607 2.077 . . . . 10.0 116.607 -162.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.308 11.1 t 37.42 -82.17 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 127.699 2.4 . . . . 10.0 116.732 -164.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.267 7.5 p 46.25 -51.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 131.35 3.86 . . . . 10.0 116.055 -161.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -20.11 0.1 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 131.487 3.915 . . . . 10.0 117.642 -168.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.4 pttm -152.49 22.57 0.62 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.844 1.658 . . . . 10.0 111.546 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -163.09 54.58 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 121.891 0.717 . . . . 10.0 111.862 -165.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.2 -123.67 5.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.467 1.984 . . . . 10.0 110.6 -176.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -160.38 165.09 31.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.421 1.088 . . . . 10.0 112.529 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -78.96 129.63 34.69 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.118 2.567 . . . . 10.0 112.011 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.72 108.92 5.01 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.422 1.089 . . . . 10.0 108.944 173.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 m 56.62 -29.03 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 127.274 2.23 . . . . 10.0 115.46 -163.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.03 136.3 12.92 Favored Glycine 0 CA--C 1.542 1.769 0 CA-C-N 120.748 1.613 . . . . 10.0 111.65 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 9.6 Cg_endo -59.66 1.57 0.39 Allowed 'Trans proline' 0 C--N 1.353 0.787 1 C-N-CA 127.2 5.266 . . . . 10.0 118.411 -173.218 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER 63.11 143.02 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.916 2.486 . . . . 10.0 114.12 -161.119 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.29 65.41 9.19 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.287 1.042 . . . . 10.0 110.913 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.81 163.58 1.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.048 1.339 . . . . 10.0 111.446 158.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.8 85.87 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.933 1.73 . . . . 10.0 116.267 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.18 -168.14 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.222 2.609 . . . . 10.0 113.215 169.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 55.02 35.28 24.33 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.819 2.448 . . . . 10.0 114.622 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 166.84 -19.64 0.09 OUTLIER Glycine 0 CA--C 1.531 1.075 0 N-CA-C 115.271 0.869 . . . . 10.0 115.271 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.422 ' HE ' ' HB2' ' A' ' 42' ' ' GLN . 4.2 ptm180 -74.58 -145.23 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.909 1.284 . . . . 10.0 110.994 164.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -151.85 -179.74 7.73 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.636 1.974 . . . . 10.0 109.072 171.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.2 p -59.8 158.32 10.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.448 1.118 . . . . 10.0 112.971 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.0 -8.24 78.75 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 116.96 1.544 . . . . 10.0 116.96 163.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.422 ' HB2' ' HE ' ' A' ' 38' ' ' ARG . 28.1 mm100 -71.13 -7.12 44.4 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.396 1.998 . . . . 10.0 116.396 -167.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.45 134.87 96.13 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.445 1.475 . . . . 10.0 111.275 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -76.77 155.67 34.97 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.014 1.809 . . . . 10.0 111.774 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 21.99 68.01 0.02 OUTLIER Glycine 0 CA--C 1.536 1.363 0 C-N-CA 128.765 3.079 . . . . 10.0 116.67 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -147.62 -42.58 0.17 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.673 0.99 . . . . 10.0 113.673 -172.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 m 60.02 83.76 0.13 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.159 2.184 . . . . 10.0 114.049 170.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -115.46 115.5 26.64 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 126.063 1.745 . . . . 10.0 112.86 -172.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.5 t 50.18 175.87 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.187 2.195 . . . . 10.0 115.119 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -78.49 -69.66 0.55 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.0 1.72 . . . . 10.0 112.316 161.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.36 -30.31 68.29 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.668 1.587 . . . . 10.0 114.21 -157.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.98 -63.42 1.16 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 119.008 0.822 . . . . 10.0 110.668 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -52.13 -43.16 63.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 119.082 -0.485 . . . . 10.0 110.432 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.67 -32.04 73.38 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.622 2.082 . . . . 10.0 116.622 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -54.43 -35.34 62.85 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.816 1.644 . . . . 10.0 113.673 -170.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.26 -9.49 47.67 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.56 1.552 . . . . 10.0 115.646 168.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.8 pp -63.0 159.93 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 126.336 1.854 . . . . 10.0 112.619 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -9.6 58.5 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.415 1.486 . . . . 10.0 114.936 -169.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.5 m95 45.28 97.42 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.556 2.742 . . . . 10.0 114.012 -162.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -161.59 -178.83 6.84 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.168 1.387 . . . . 10.0 109.917 -169.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -61.21 -29.62 69.93 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.667 1.729 . . . . 10.0 115.667 -155.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.49 -51.15 31.01 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 122.299 2.318 . . . . 10.0 111.484 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.4 p -72.32 -40.53 67.4 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.274 1.429 . . . . 10.0 113.153 -174.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.26 -30.24 64.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.977 0.911 . . . . 10.0 111.88 174.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 36.8 ttm -67.81 -48.7 65.5 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.493 -0.765 . . . . 10.0 109.565 169.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -54.3 -44.75 72.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.876 0.762 . . . . 10.0 110.916 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -69.39 -55.95 8.87 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.401 -0.809 . . . . 10.0 112.659 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.51 -11.03 60.49 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.814 1.643 . . . . 10.0 114.379 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -84.72 -29.46 25.53 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 120.507 1.503 . . . . 10.0 112.854 163.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.5 75.61 1.81 Allowed Pre-proline 0 CA--C 1.558 1.267 0 CA-C-N 119.106 0.866 . . . . 10.0 113.002 -172.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -71.3 -56.77 0.11 Allowed 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.486 2.124 . . . . 10.0 112.824 -163.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -65.02 -17.54 64.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.028 1.331 . . . . 10.0 113.905 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -76.34 -49.5 16.7 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.265 1.426 . . . . 10.0 111.586 165.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -62.93 -34.35 77.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.421 0.897 . . . . 10.0 113.421 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.84 125.45 7.46 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.393 1.477 . . . . 10.0 110.66 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.85 169.01 21.34 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.636 2.224 . . . . 10.0 112.657 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.31 -104.46 1.28 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.458 -1.457 . . . . 10.0 109.458 -166.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.4 m 59.93 -39.67 0.09 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 129.217 3.007 . . . . 10.0 118.364 165.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 59.97 -57.59 0.07 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 128.237 2.615 . . . . 10.0 116.311 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt -3.7 87.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 129.824 3.25 . . . . 10.0 113.772 -168.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.9 mp -77.23 70.4 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.82 1.648 . . . . 10.0 109.884 -166.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -163.01 -27.08 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.852 1.661 . . . . 10.0 113.02 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.86 -12.57 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 121.136 3.754 . . . . 10.0 121.136 172.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.34 -142.73 3.46 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 120.688 1.585 . . . . 10.0 111.808 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -144.71 165.12 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.805 0.842 . . . . 10.0 109.912 159.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -67.82 -21.33 65.22 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.852 1.797 . . . . 10.0 115.852 -167.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -163.07 140.68 7.84 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.416 1.486 . . . . 10.0 109.703 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -54.94 -41.79 71.49 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 -159.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -46.08 64.1 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.144 0.977 . . . . 10.0 111.159 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -58.03 -25.8 61.62 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.033 0.933 . . . . 10.0 112.305 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -29.05 59.85 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.853 0.861 . . . . 10.0 113.317 174.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -72.17 -47.19 52.66 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.592 1.157 . . . . 10.0 110.24 169.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.35 -39.41 79.44 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.647 1.179 . . . . 10.0 112.332 174.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.56 -48.45 79.31 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 168.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.7 mm -60.43 -45.14 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.078 0.854 . . . . 10.0 109.823 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.74 80.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.097 0.559 . . . . 10.0 112.453 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.7 -60.38 3.93 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.208 1.003 . . . . 10.0 112.075 174.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.27 -24.52 65.79 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -171.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -57.72 -55.02 40.25 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.884 0.765 . . . . 10.0 111.208 165.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -67.28 -33.19 74.78 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 117.853 -1.07 . . . . 10.0 113.505 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.12 -12.36 2.14 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.619 1.341 . . . . 10.0 114.619 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 p -76.63 -11.16 59.81 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.191 1.397 . . . . 10.0 114.209 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.26 9.45 0.42 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.048 1.339 . . . . 10.0 114.559 -168.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.973 2.909 . . . . 10.0 109.138 -174.054 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.427 0 CA-C-O 119.324 -0.709 . . . . 10.0 112.753 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' H ' ' HA ' ' A' ' 93' ' ' ASP . 1.0 OUTLIER -123.39 105.26 9.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 117.893 0.846 . . . . 10.0 109.671 -155.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.9 t -46.4 -48.98 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.57 1.548 . . . . 10.0 111.819 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -66.21 -34.7 78.62 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.096 1.358 . . . . 10.0 113.207 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -73.21 -31.64 64.29 Favored 'General case' 0 C--O 1.23 0.063 0 C-N-CA 123.803 0.841 . . . . 10.0 111.754 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.54 -42.14 56.06 Favored Glycine 0 C--O 1.226 -0.349 0 N-CA-C 109.588 -1.405 . . . . 10.0 109.588 -171.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -55.67 -48.16 75.51 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 171.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.65 66.83 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.685 0.994 . . . . 10.0 113.685 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.77 -40.18 76.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 119.658 1.117 . . . . 10.0 110.837 169.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.2 -55.17 30.54 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.709 0.686 . . . . 10.0 109.94 175.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.54 -8.83 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -96.63 -47.57 5.86 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.194 1.398 . . . . 10.0 111.567 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -117.58 -8.33 10.96 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.067 1.506 . . . . 10.0 115.067 -168.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -115.98 -44.56 2.91 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.582 1.553 . . . . 10.0 110.93 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.24 -8.07 5.18 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.81 1.041 . . . . 10.0 113.81 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.57 -15.51 58.27 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.477 1.511 . . . . 10.0 113.057 166.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -143.92 -44.87 0.27 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.934 1.694 . . . . 10.0 113.037 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -85.72 -164.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.768 2.027 . . . . 10.0 110.593 171.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 20' ' ' VAL . 1.4 t -150.19 -77.06 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.528 1.131 . . . . 10.0 111.153 168.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.505 ' H ' HG23 ' A' ' 19' ' ' THR 0.268 0.9 OUTLIER 49.75 -18.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 129.699 3.2 . . . . 10.0 117.204 -171.812 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -68.42 51.21 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 129.336 3.054 . . . . 10.0 113.315 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 mttm 57.71 -21.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 129.466 3.106 . . . . 10.0 117.013 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.69 75.64 1.43 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 126.501 2.0 . . . . 10.0 112.637 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -53.69 101.19 0.08 OUTLIER Glycine 0 CA--C 1.534 1.223 0 C-N-CA 126.135 1.826 . . . . 10.0 114.745 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -164.81 65.99 0.14 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.389 1.876 . . . . 10.0 112.082 -167.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.481 ' HD2' ' O ' ' A' ' 45' ' ' GLY . 1.9 p-80 -64.39 115.48 5.14 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 167.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -142.14 -25.59 0.66 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.968 0.907 . . . . 10.0 113.348 -164.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 m -153.01 -19.59 0.15 Allowed 'General case' 0 N--CA 1.477 0.897 0 O-C-N 120.794 -1.191 . . . . 10.0 111.884 167.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.06 150.85 17.27 Favored Glycine 0 CA--C 1.546 2.02 0 C-N-CA 124.666 1.127 . . . . 10.0 111.689 161.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -78.4 38.98 0.73 Allowed 'Trans proline' 0 CA--C 1.542 0.911 1 C-N-CA 125.354 4.036 . . . . 10.0 116.634 -163.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 56.42 -163.37 0.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.646 -1.284 . . . . 10.0 110.22 -161.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.56 27.44 1.53 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.28 1.832 . . . . 10.0 111.577 172.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.431 ' CE1' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER -53.14 107.26 0.22 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.635 2.374 . . . . 10.0 114.339 -176.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.03 11.34 58.35 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 126.084 1.802 . . . . 10.0 115.045 173.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 161.89 4.21 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.174 0.987 . . . . 10.0 110.403 166.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 62.77 44.43 6.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.564 1.546 . . . . 10.0 113.121 -155.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 164.08 -44.13 0.31 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.452 1.501 . . . . 10.0 111.034 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.405 HH21 ' HB3' ' A' ' 42' ' ' GLN . 25.0 mtp85 -82.24 159.09 23.29 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.411 0.624 . . . . 10.0 111.495 169.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -85.36 164.92 17.66 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.96 1.304 . . . . 10.0 111.66 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.9 t -60.65 151.35 29.35 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.882 1.273 . . . . 10.0 111.787 171.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.36 8.44 49.85 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 117.154 1.622 . . . . 10.0 117.154 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.431 HE21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -65.87 -15.73 63.19 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 115.604 1.705 . . . . 10.0 115.604 -171.258 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.38 109.43 1.37 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.452 1.901 . . . . 10.0 114.868 -162.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.04 52.92 3.99 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.469 3.446 . . . . 10.0 112.395 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.481 ' O ' ' HD2' ' A' ' 26' ' ' HIS . . . 126.94 73.84 0.19 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.498 1.523 . . . . 10.0 112.328 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -157.2 -79.94 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.918 0.887 . . . . 10.0 111.485 171.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 24.7 m 55.28 102.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.511 1.525 . . . . 10.0 112.176 -155.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -55.03 4.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.582 1.953 . . . . 10.0 110.305 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 71.9 p -144.69 175.81 9.89 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.216 2.606 . . . . 10.0 108.04 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -76.6 -60.48 2.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.804 1.642 . . . . 10.0 112.84 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.16 -52.45 65.29 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.766 1.226 . . . . 10.0 113.883 -153.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -58.82 -58.87 6.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.599 0.76 . . . . 10.0 112.885 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -39.95 76.34 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.528 1.131 . . . . 10.0 113.139 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -61.67 -34.91 76.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.178 0.899 . . . . 10.0 113.241 173.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -75.13 -10.99 59.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.118 1.525 . . . . 10.0 115.118 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.06 12.29 57.23 Favored Glycine 0 CA--C 1.542 1.781 0 N-CA-C 117.663 1.825 . . . . 10.0 117.663 163.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -55.4 4.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 119.449 3.129 . . . . 10.0 119.449 -161.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 m 55.62 104.58 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.825 2.45 . . . . 10.0 114.625 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.425 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 9.1 m95 -72.53 119.49 16.82 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 121.182 -0.949 . . . . 10.0 111.777 171.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -163.81 167.84 20.34 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.593 1.157 . . . . 10.0 111.146 -155.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -68.61 23.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.81 2.844 . . . . 10.0 114.427 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -158.91 17.48 0.19 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.895 2.878 . . . . 10.0 110.651 -168.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.7 p -158.45 -37.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.244 1.818 . . . . 10.0 110.656 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.64 HD22 HH12 ' A' ' 91' ' ' ARG . 1.0 OUTLIER -75.38 -22.27 57.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 114.424 1.268 . . . . 10.0 114.424 174.636 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.7 mtm -67.76 -52.73 33.93 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.88 0.763 . . . . 10.0 110.686 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -61.97 -41.47 98.04 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.46 0.475 . . . . 10.0 110.527 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.76 -53.23 43.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 113.316 0.858 . . . . 10.0 113.316 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.7 tp -65.96 -33.47 75.9 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.062 1.301 . . . . 10.0 112.415 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -70.34 -28.3 65.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 172.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -161.38 75.94 2.42 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.626 1.17 . . . . 10.0 112.353 -172.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.99 -48.68 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.612 2.208 . . . . 10.0 111.93 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 32.38 0.08 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.35 2.26 . . . . 10.0 114.268 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.26 -43.65 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 128.006 2.522 . . . . 10.0 110.45 -167.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -68.06 -36.82 80.5 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 174.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.44 143.55 41.57 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.702 0.801 . . . . 10.0 111.224 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -76.72 158.75 35.4 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.151 2.568 . . . . 10.0 111.379 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 57.49 55.8 28.5 Favored Glycine 0 C--N 1.34 0.778 0 C-N-CA 123.868 0.747 . . . . 10.0 112.044 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -126.68 151.01 48.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.125 1.77 . . . . 10.0 109.445 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -142.55 5.92 1.63 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.332 1.453 . . . . 10.0 113.87 -169.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -54.75 92.64 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.746 1.618 . . . . 10.0 113.035 173.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.77 83.22 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.484 1.514 . . . . 10.0 110.069 175.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -162.3 -53.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.069 0.766 . . . . 10.0 113.069 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.71 87.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.078 2.551 . . . . 10.0 117.254 168.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.78 95.87 1.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 123.374 0.511 . . . . 10.0 112.134 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.65 -21.11 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -166.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 73.63 148.33 0.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.162 2.585 . . . . 10.0 110.943 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm 46.95 -13.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 130.554 3.541 . . . . 10.0 118.298 -162.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.6 mttm 49.11 -9.72 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 131.406 3.882 . . . . 10.0 118.754 163.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.0 m -63.9 -26.77 68.75 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 122.726 2.512 . . . . 10.0 111.188 156.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -53.29 -33.32 52.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.195 0.998 . . . . 10.0 112.955 163.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.64 HH12 HD22 ' A' ' 64' ' ' LEU . 3.9 tpm_? -66.59 -44.49 82.02 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 116.981 -1.485 . . . . 10.0 110.404 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.17 -45.42 93.15 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.419 1.009 . . . . 10.0 110.335 177.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.424 ' HA ' ' H ' ' A' ' 2' ' ' ASP . 77.2 m-20 -59.79 -49.42 77.8 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.467 1.507 . . . . 10.0 110.911 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -40.95 97.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.469 0.914 . . . . 10.0 113.469 174.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.8 mm -54.71 -56.2 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 171.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.54 42.76 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.028 0.931 . . . . 10.0 111.075 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.446 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 9.2 t80 -52.0 -59.11 4.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.081 1.752 . . . . 10.0 112.36 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.446 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 15.1 mt -71.51 -30.91 66.48 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.946 0.794 . . . . 10.0 113.01 -175.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -61.43 -52.97 62.37 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 118.995 0.816 . . . . 10.0 109.862 171.222 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -37.72 82.51 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 117.453 -1.26 . . . . 10.0 113.189 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.73 -7.18 4.45 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.8 p -69.41 -16.92 63.6 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.883 -1.136 . . . . 10.0 113.538 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -153.61 43.73 0.59 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.77 1.228 . . . . 10.0 111.8 -162.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 129.635 3.174 . . . . 10.0 110.506 163.276 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.425 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.019 0 N-CA-C 109.693 -1.363 . . . . 10.0 109.693 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -109.33 150.56 27.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.147 0.979 . . . . 10.0 111.562 -174.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.6 m -70.8 -40.27 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 121.244 -0.91 . . . . 10.0 112.24 -174.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 mp0 -59.12 -51.84 68.3 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.425 1.49 . . . . 10.0 110.288 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -56.93 -21.61 31.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.995 1.718 . . . . 10.0 114.167 174.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.74 -43.04 3.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 119.074 0.852 . . . . 10.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -60.8 -42.04 96.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.797 1.298 . . . . 10.0 112.757 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -36.51 81.8 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.55 1.14 . . . . 10.0 112.627 -176.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.569 HG23 HD11 ' A' ' 94' ' ' LEU . 9.8 tp -85.99 -34.53 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 124.059 0.944 . . . . 10.0 111.217 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -57.35 -50.88 71.54 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 118.929 0.786 . . . . 10.0 110.318 171.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.4 t -65.01 -8.1 5.05 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -97.67 -48.69 5.13 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.241 1.417 . . . . 10.0 112.56 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' HD11 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -121.75 -0.24 9.68 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.391 1.626 . . . . 10.0 115.391 -171.86 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.2 m -117.61 -43.47 2.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.862 1.265 . . . . 10.0 111.655 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.88 -10.09 8.47 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -16.62 52.6 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 10.0 112.854 167.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.1 m -143.24 -34.82 0.41 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.468 1.507 . . . . 10.0 114.002 -175.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -105.45 174.25 5.96 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.362 2.665 . . . . 10.0 111.837 -178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.0 m -160.92 90.29 0.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 119.735 -1.853 . . . . 10.0 112.732 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.8 p -95.76 -36.26 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 N-CA-C 114.103 1.149 . . . . 10.0 114.103 171.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.96 -0.73 12.22 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.838 -1.164 . . . . 10.0 114.061 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -151.54 -166.27 2.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.057 2.543 . . . . 10.0 107.115 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -66.24 53.81 0.18 Allowed Glycine 0 CA--C 1.541 1.692 0 N-CA-C 118.058 1.983 . . . . 10.0 118.058 -167.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.85 8.01 56.63 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 117.54 1.776 . . . . 10.0 117.54 156.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -64.57 159.48 21.69 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.348 1.059 . . . . 10.0 112.42 -173.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -152.41 91.29 1.57 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.753 1.621 . . . . 10.0 108.259 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -96.58 -29.21 13.98 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.703 1.601 . . . . 10.0 113.194 -167.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 91.1 m -154.1 -20.04 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 O-C-N 120.963 -1.086 . . . . 10.0 111.903 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -116.97 171.67 13.9 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 110.499 -1.04 . . . . 10.0 110.499 154.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -61.65 178.98 0.56 Allowed 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.846 5.031 . . . . 10.0 114.167 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -83.53 -10.24 58.43 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.325 1.602 . . . . 10.0 115.325 -168.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.4 mp 45.5 69.42 0.45 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.618 1.167 . . . . 10.0 110.59 -158.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.413 ' CE1' HH21 ' A' ' 38' ' ' ARG . 0.5 OUTLIER -55.56 -179.24 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.64 1.176 . . . . 10.0 111.51 163.19 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -36.53 137.92 0.45 Allowed Glycine 0 CA--C 1.538 1.523 0 O-C-N 121.491 -0.756 . . . . 10.0 112.356 161.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -151.86 171.74 17.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 130.064 3.346 . . . . 10.0 109.097 -167.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 68.38 86.19 0.13 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.03 1.732 . . . . 10.0 112.784 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.4 60.71 1.43 Allowed Glycine 0 CA--C 1.527 0.809 0 CA-C-N 115.016 -0.993 . . . . 10.0 112.989 172.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.413 HH21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -152.21 -94.26 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.494 1.118 . . . . 10.0 110.328 172.815 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -154.5 -129.41 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.651 1.18 . . . . 10.0 110.608 165.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.9 t -158.63 167.69 28.89 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 128.33 2.652 . . . . 10.0 108.082 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.18 46.29 4.17 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 115.98 1.152 . . . . 10.0 115.98 174.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -128.94 1.0 5.32 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.651 1.723 . . . . 10.0 115.651 -173.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.85 116.91 27.39 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 120.855 1.661 . . . . 10.0 112.225 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.83 -39.25 0.69 Allowed 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.495 2.13 . . . . 10.0 114.197 -158.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -119.15 49.08 0.89 Allowed Glycine 0 C--N 1.34 0.788 0 C-N-CA 124.439 1.018 . . . . 10.0 112.322 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -141.72 -41.04 0.36 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 118.384 -0.817 . . . . 10.0 113.172 -172.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 t 43.91 87.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.493 1.917 . . . . 10.0 115.297 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -172.9 4.03 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 126.647 1.979 . . . . 10.0 113.283 -172.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.7 p -64.13 155.45 31.49 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.222 -0.924 . . . . 10.0 111.793 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.18 -50.39 16.39 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.847 2.059 . . . . 10.0 112.41 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.32 30.64 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 128.379 2.672 . . . . 10.0 116.464 -164.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -161.23 -70.16 0.06 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.039 3.336 . . . . 10.0 107.145 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -55.3 22.59 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.997 1.719 . . . . 10.0 112.555 178.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.9 -32.34 73.8 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.269 0.94 . . . . 10.0 112.021 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -60.66 -16.56 40.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.011 1.325 . . . . 10.0 113.337 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.68 14.93 79.51 Favored Glycine 0 CA--C 1.535 1.308 0 N-CA-C 115.914 1.126 . . . . 10.0 115.914 163.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -55.45 0.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.219 2.607 . . . . 10.0 117.993 -167.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.8 m 55.47 107.51 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 128.941 2.896 . . . . 10.0 115.161 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -67.82 131.63 45.88 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.747 0.784 . . . . 10.0 112.576 170.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -165.1 162.66 20.35 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.348 1.459 . . . . 10.0 110.682 -155.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.35 35.28 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 129.399 3.08 . . . . 10.0 113.602 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -162.06 -74.54 0.05 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 128.235 2.614 . . . . 10.0 107.578 -164.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.4 p -57.88 -37.03 73.24 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.064 2.145 . . . . 10.0 112.582 -176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.42 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.92 -23.61 55.49 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.765 1.226 . . . . 10.0 113.68 176.024 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 35.7 mtm -71.99 -48.27 46.05 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.65 -0.656 . . . . 10.0 109.948 170.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -57.5 -51.79 68.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.657 1.183 . . . . 10.0 110.829 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -59.3 -52.03 67.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 118.308 -0.853 . . . . 10.0 112.44 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.404 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -63.36 -48.04 79.59 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.591 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HA ' ' HA2' ' A' ' 84' ' ' GLY . 14.1 mm-40 -62.6 -29.13 70.37 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.27 1.211 . . . . 10.0 114.27 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -162.25 97.71 1.17 Allowed Pre-proline 0 CA--C 1.546 0.8 0 CA-C-N 119.156 0.889 . . . . 10.0 112.01 161.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.14 -49.22 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.398 2.065 . . . . 10.0 110.838 -172.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -61.4 -23.19 65.63 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.956 1.702 . . . . 10.0 113.775 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -52.56 9.54 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.028 1.331 . . . . 10.0 112.273 163.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -61.85 -32.38 72.71 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.122 0.786 . . . . 10.0 113.122 -175.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.54 148.0 54.42 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 126.077 1.751 . . . . 10.0 110.82 172.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.42 -8.45 19.59 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.94 2.427 . . . . 10.0 114.094 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -141.25 78.52 0.29 Allowed Glycine 0 C--N 1.34 0.763 0 C-N-CA 123.938 0.78 . . . . 10.0 113.126 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.7 m -133.91 119.46 19.14 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.746 0.818 . . . . 10.0 113.091 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -85.99 6.12 30.18 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 116.016 1.858 . . . . 10.0 116.016 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.57 109.32 0.68 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.438 1.095 . . . . 10.0 111.364 173.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 26.0 mm -83.74 77.31 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 124.999 1.319 . . . . 10.0 110.035 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -163.85 -42.74 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 167.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.67 -146.19 0.2 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.296 1.038 . . . . 10.0 113.198 -162.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 69' ' ' GLU . . . -57.0 150.26 28.86 Favored Glycine 0 C--N 1.343 0.949 0 C-N-CA 124.607 1.099 . . . . 10.0 115.479 -163.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 tt -69.58 -9.86 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.552 1.316 . . . . 10.0 114.552 -163.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.2 tttm 56.68 51.11 11.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.686 1.994 . . . . 10.0 111.716 -178.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.31 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.046 1.738 . . . . 10.0 115.235 175.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 mptt 47.5 -56.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 129.441 3.096 . . . . 10.0 116.351 -162.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.5 m -58.66 -37.61 76.36 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 121.358 1.89 . . . . 10.0 112.495 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -52.75 -38.47 60.96 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.356 0.662 . . . . 10.0 111.86 171.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.42 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -61.17 -46.69 89.48 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.839 -1.163 . . . . 10.0 110.932 -178.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.95 -22.77 55.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.783 1.031 . . . . 10.0 113.783 175.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -62.85 -49.76 73.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.813 1.188 . . . . 10.0 110.264 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.569 HD11 HG23 ' A' ' 9' ' ' ILE . 3.6 mp -59.51 -40.58 87.58 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.148 -0.97 . . . . 10.0 113.29 174.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.59 -48.79 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 119.053 0.842 . . . . 10.0 109.022 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -50.23 74.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.101 0.409 . . . . 10.0 111.344 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -53.71 -55.73 23.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.006 1.323 . . . . 10.0 112.847 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.97 -28.71 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.326 0.966 . . . . 10.0 112.608 -175.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -66.63 -18.96 65.65 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.376 1.071 . . . . 10.0 112.625 171.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -85.95 -58.19 2.74 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 117.223 -1.37 . . . . 10.0 111.377 158.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.16 -18.62 37.85 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 115.948 1.833 . . . . 10.0 115.948 -170.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.2 t -64.19 -19.97 65.7 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.011 1.324 . . . . 10.0 114.509 166.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.22 -4.21 0.2 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.538 2.051 . . . . 10.0 116.538 -167.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 C--O 1.25 1.095 0 C-N-CA 126.155 1.782 . . . . 10.0 111.274 -171.525 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 CA-C-O 118.111 -1.383 . . . . 10.0 114.828 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -80.7 163.98 23.15 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.606 1.703 . . . . 10.0 111.442 166.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.03 -50.3 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.678 1.191 . . . . 10.0 110.597 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.36 -49.95 65.16 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.951 -1.093 . . . . 10.0 113.114 -170.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -57.29 -32.1 66.3 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.732 0.413 . . . . 10.0 111.527 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.34 -41.74 58.32 Favored Glycine 0 C--N 1.34 0.754 0 C-N-CA 124.535 1.064 . . . . 10.0 111.287 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -69.7 -33.8 73.02 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 118.15 0.975 . . . . 10.0 111.978 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -53.58 55.9 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.932 1.293 . . . . 10.0 110.311 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.96 -33.19 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 118.61 -0.709 . . . . 10.0 112.696 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.7 t80 -56.59 -54.08 50.18 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 119.725 1.148 . . . . 10.0 110.723 170.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.87 -10.09 6.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 112.932 0.715 . . . . 10.0 112.932 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -90.06 -52.32 5.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.195 1.398 . . . . 10.0 111.354 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -134.55 10.12 3.7 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -167.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.0 m -113.26 -42.29 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.11 1.364 . . . . 10.0 110.719 167.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.35 -14.61 19.54 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -66.13 -10.28 39.41 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.923 1.689 . . . . 10.0 114.741 168.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -143.43 -34.68 0.4 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.76 1.224 . . . . 10.0 112.98 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -114.41 -175.42 2.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.597 2.359 . . . . 10.0 111.956 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -146.04 176.74 9.49 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.317 0.647 . . . . 10.0 110.756 151.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.3 p -162.34 -41.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 127.139 2.176 . . . . 10.0 109.765 156.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -67.47 -51.9 45.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.996 0.918 . . . . 10.0 111.091 166.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -85.26 82.87 8.19 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.5 1.12 . . . . 10.0 110.158 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.7 -73.69 0.16 Allowed Glycine 0 CA--C 1.534 1.23 0 C-N-CA 127.341 2.401 . . . . 10.0 115.757 167.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 154.6 114.93 0.53 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.122 1.344 . . . . 10.0 111.984 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -163.86 157.26 18.59 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.707 2.003 . . . . 10.0 110.747 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -156.19 108.16 2.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.744 2.018 . . . . 10.0 107.369 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -144.27 -82.08 0.17 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.286 1.034 . . . . 10.0 110.866 -167.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.495 ' O ' HMD3 ' A' ' 105' ' ' HEC . 0.4 OUTLIER -79.71 -23.76 42.15 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 117.984 0.356 . . . . 10.0 110.957 177.149 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -144.51 175.92 23.97 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.814 2.15 . . . . 10.0 110.82 160.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.07 -179.18 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.273 3.982 . . . . 10.0 113.936 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -93.68 16.27 14.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.347 2.659 . . . . 10.0 115.741 -169.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp 38.85 55.1 2.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.99 2.116 . . . . 10.0 112.924 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -56.94 84.73 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.595 2.758 . . . . 10.0 114.112 -178.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.25 32.19 60.07 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.413 1.482 . . . . 10.0 114.962 166.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.0 179.25 0.71 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.183 0.993 . . . . 10.0 113.429 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.604 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 4.1 m-85 52.81 42.95 31.98 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 124.802 1.241 . . . . 10.0 111.068 -166.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 1.68 0.07 OUTLIER Glycine 0 CA--C 1.542 1.77 0 C-N-CA 126.945 2.212 . . . . 10.0 115.208 -163.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.9 mtp85 -152.41 163.33 39.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.118 1.767 . . . . 10.0 110.848 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -83.72 172.76 11.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.02 2.128 . . . . 10.0 112.999 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 50.6 p -81.73 179.63 7.75 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.581 1.152 . . . . 10.0 112.125 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.72 -32.1 4.07 Favored Glycine 0 CA--C 1.529 0.956 0 O-C-N 120.88 -1.137 . . . . 10.0 114.5 176.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 44.3 mm-40 -64.98 6.32 0.25 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 128.708 2.803 . . . . 10.0 116.623 -161.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.17 145.0 79.76 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 119.405 1.002 . . . . 10.0 108.939 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.57 70.31 4.97 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.415 2.743 . . . . 10.0 111.323 -177.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.35 -79.27 0.23 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.918 1.723 . . . . 10.0 111.987 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 48.62 -14.33 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 130.438 3.495 . . . . 10.0 117.883 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 m 76.38 75.82 0.09 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 129.787 3.235 . . . . 10.0 112.025 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -84.27 170.0 14.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.943 1.297 . . . . 10.0 111.849 159.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 82.1 p -69.59 -1.37 8.64 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 116.226 1.936 . . . . 10.0 116.226 -172.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.4 t70 46.3 -157.33 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.456 0.702 . . . . 10.0 110.912 -146.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.25 -76.12 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.357 2.663 . . . . 10.0 113.147 -168.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -49.94 -71.64 0.06 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.212 1.805 . . . . 10.0 111.4 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.514 ' HZ2' ' CGA' ' A' ' 105' ' ' HEC . 29.8 mmmt -57.07 -42.3 80.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.616 1.966 . . . . 10.0 111.246 -172.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.11 -59.9 3.61 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.591 2.356 . . . . 10.0 112.525 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -62.29 -52.01 65.41 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.905 0.882 . . . . 10.0 111.552 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.3 -179.99 19.01 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 122.436 1.02 . . . . 10.0 115.203 -172.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.07 -1.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 128.747 2.819 . . . . 10.0 112.544 -169.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.8 m 55.39 106.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.86 2.064 . . . . 10.0 113.181 -162.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -67.38 123.15 19.57 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.31 -0.869 . . . . 10.0 111.692 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -162.57 178.15 8.81 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.172 2.189 . . . . 10.0 110.907 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.91 41.93 0.05 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.127 2.971 . . . . 10.0 113.344 -174.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -161.64 -64.45 0.05 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.563 3.145 . . . . 10.0 108.396 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.1 p -62.48 -43.81 97.92 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.176 1.39 . . . . 10.0 112.416 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.69 -25.3 60.17 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.131 0.573 . . . . 10.0 111.405 173.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 34.3 ttm -63.95 -52.42 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.204 0.911 . . . . 10.0 109.234 170.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -60.86 -44.67 96.7 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.499 0.72 . . . . 10.0 111.146 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.29 -48.27 76.31 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.499 -0.762 . . . . 10.0 111.674 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -42.16 99.01 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.079 1.308 . . . . 10.0 111.066 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.97 -45.51 74.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.107 0.867 . . . . 10.0 112.282 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -160.6 76.77 2.62 Favored Pre-proline 0 CA--C 1.559 1.307 0 C-N-CA 124.656 1.182 . . . . 10.0 111.034 -163.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.92 -67.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.473 3.449 . . . . 10.0 114.271 -161.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -58.64 -20.29 46.56 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.176 1.79 . . . . 10.0 113.233 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -48.06 24.58 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.828 2.051 . . . . 10.0 111.428 170.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -61.19 -41.1 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.629 0.772 . . . . 10.0 112.855 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 pt -139.53 135.89 17.29 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.711 0.805 . . . . 10.0 111.208 -175.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -78.37 65.92 8.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.438 3.425 . . . . 10.0 112.786 -168.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.36 -145.96 4.65 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 126.423 1.963 . . . . 10.0 109.614 175.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 93.0 m 74.86 147.6 0.09 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.065 2.146 . . . . 10.0 114.636 168.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -141.56 21.6 2.18 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.946 2.098 . . . . 10.0 111.666 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 21.7 ttt -59.49 98.6 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.156 1.382 . . . . 10.0 109.561 158.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.5 mp -75.57 57.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.262 1.025 . . . . 10.0 110.3 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -163.64 107.05 0.99 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.29 1.036 . . . . 10.0 111.417 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.89 -162.04 0.2 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.096 1.358 . . . . 10.0 111.942 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.26 60.26 0.01 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 127.58 2.514 . . . . 10.0 117.051 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.331 5.6 tt 44.71 -122.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.343 2.657 . . . . 10.0 112.042 175.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -142.31 -73.8 0.3 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.31 1.444 . . . . 10.0 110.15 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.81 115.52 3.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 161.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -64.04 -21.71 66.62 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.133 0.879 . . . . 10.0 111.373 170.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.7 m -53.1 -50.91 63.46 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.145 0.978 . . . . 10.0 112.339 164.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.25 -30.36 66.49 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.551 1.069 . . . . 10.0 111.341 176.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -19.57 59.48 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.545 1.138 . . . . 10.0 113.869 173.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.76 -62.97 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.398 1.454 . . . . 10.0 108.189 160.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.58 -48.48 72.05 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 126.458 1.903 . . . . 10.0 111.198 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.2 tp -60.44 -47.7 84.96 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.7 mm -65.57 -44.02 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.905 -0.497 . . . . 10.0 110.075 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.53 -35.39 80.33 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.217 1.007 . . . . 10.0 111.609 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.445 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.0 t80 -57.12 -66.44 0.45 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.675 1.19 . . . . 10.0 110.952 165.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 51.7 mt -62.86 -29.9 71.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.604 ' HE2' ' HB3' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -57.46 -46.92 83.11 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.54 1.064 . . . . 10.0 110.983 172.519 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -91.22 -38.24 12.82 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 117.983 -1.008 . . . . 10.0 111.684 -172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.71 -13.33 9.53 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.837 1.655 . . . . 10.0 115.013 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.58 -2.38 14.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.581 1.152 . . . . 10.0 113.346 168.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -151.4 -53.8 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.73 2.012 . . . . 10.0 111.816 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 126.697 1.999 . . . . 10.0 113.215 -178.176 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.514 ' CGA' ' HZ2' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.768 0 CA-C-O 118.716 -1.047 . . . . 10.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -136.82 155.2 50.11 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.475 0.917 . . . . 10.0 113.475 -144.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 94.6 t -58.57 -56.09 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 126.183 1.793 . . . . 10.0 111.544 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -59.46 -36.46 75.99 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.37 1.468 . . . . 10.0 112.004 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -77.75 -8.97 58.73 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.221 1.808 . . . . 10.0 114.666 174.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.23 -41.47 5.51 Favored Glycine 0 N--CA 1.471 1.0 0 CA-C-N 119.707 1.14 . . . . 10.0 112.092 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.08 68.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.726 -0.867 . . . . 10.0 113.036 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -30.07 67.71 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.492 1.293 . . . . 10.0 114.492 177.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -86.11 -31.1 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 119.026 0.83 . . . . 10.0 110.325 173.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t80 -58.08 -52.02 67.26 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 122.072 -0.393 . . . . 10.0 111.336 169.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.86 -9.89 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.366 0.876 . . . . 10.0 113.366 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -82.55 -52.18 7.08 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.055 0.942 . . . . 10.0 110.742 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -116.06 -52.67 2.59 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.285 1.034 . . . . 10.0 112.595 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 9.5 m -59.53 -43.01 93.59 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.902 0.881 . . . . 10.0 112.666 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.417 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -62.9 -12.2 23.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.658 1.355 . . . . 10.0 114.658 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.88 -14.77 63.11 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.618 1.099 . . . . 10.0 112.252 170.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 91.7 m -143.03 -26.95 0.58 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.665 1.358 . . . . 10.0 114.665 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.426 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.4 m-70 -109.54 -56.26 2.33 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.201 1.4 . . . . 10.0 114.127 -174.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.417 ' H ' ' HA ' ' A' ' 15' ' ' ALA 0.294 9.8 t 44.67 53.31 7.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.187 1.795 . . . . 10.0 114.016 -175.719 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.71 -28.38 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 120.789 -1.194 . . . . 10.0 112.752 175.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.82 4.74 0.26 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.542 1.937 . . . . 10.0 114.712 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -149.79 13.57 0.81 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.75 2.42 . . . . 10.0 111.501 169.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.2 40.23 51.93 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.86 1.219 . . . . 10.0 112.957 -173.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.49 179.28 53.17 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 123.079 1.377 . . . . 10.0 114.52 -165.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -56.73 111.81 1.12 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.265 1.426 . . . . 10.0 113.057 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -68.02 61.01 0.08 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.61 1.964 . . . . 10.0 111.846 170.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -82.64 -19.99 37.17 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.269 1.827 . . . . 10.0 112.821 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.3 m -153.74 -18.93 0.14 Allowed 'General case' 0 N--CA 1.479 0.997 0 O-C-N 120.983 -1.073 . . . . 10.0 113.332 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.99 165.82 21.65 Favored Glycine 0 CA--C 1.54 1.656 0 CA-C-N 119.645 1.111 . . . . 10.0 110.99 157.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 49.3 Cg_endo -67.96 22.86 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.045 1 C-N-CA 126.478 4.785 . . . . 10.0 116.342 -173.728 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.349 0.0 OUTLIER 49.56 6.38 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 128.726 2.811 . . . . 10.0 117.931 -169.561 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.11 -34.21 0.28 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.728 2.411 . . . . 10.0 113.966 171.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.43 68.11 0.17 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 131.148 3.779 . . . . 10.0 114.13 169.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 32.85 68.05 0.18 Allowed Glycine 0 C--N 1.345 1.061 0 C-N-CA 127.587 2.517 . . . . 10.0 113.456 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -93.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.661 0.785 . . . . 10.0 112.322 -164.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 33.86 62.05 0.46 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.749 2.42 . . . . 10.0 115.358 161.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.35 -24.32 16.11 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.095 1.807 . . . . 10.0 114.151 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -68.06 168.18 12.5 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.955 1.378 . . . . 10.0 111.059 164.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -84.96 166.04 17.09 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.082 1.141 . . . . 10.0 114.082 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.4 p -67.55 -71.57 0.2 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 128.42 2.688 . . . . 10.0 112.964 -174.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -73.5 67.7 1.55 Allowed Glycine 0 C--N 1.339 0.703 0 C-N-CA 126.99 2.233 . . . . 10.0 112.988 -171.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.86 -2.98 7.73 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -173.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.06 118.84 59.47 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.551 1.14 . . . . 10.0 111.592 -176.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.89 81.75 1.86 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.069 2.513 . . . . 10.0 113.088 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.96 -7.75 70.09 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 125.403 1.478 . . . . 10.0 115.249 170.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -64.37 113.72 3.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.047 1.339 . . . . 10.0 110.615 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 m -71.18 142.55 50.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.399 1.48 . . . . 10.0 111.657 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.619 ' CG ' ' HE3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -155.0 178.41 10.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.082 1.142 . . . . 10.0 114.082 -169.221 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 p -67.52 120.93 14.77 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 10.0 111.924 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -75.07 36.38 0.11 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.676 1.59 . . . . 10.0 113.601 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.97 11.45 2.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.128 1.371 . . . . 10.0 114.625 -166.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.66 -33.97 0.05 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 117.905 -1.045 . . . . 10.0 113.791 -168.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HE3' ' CG ' ' A' ' 48' ' ' TYR . 1.7 mppt? -64.48 -48.81 73.83 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.763 1.165 . . . . 10.0 108.071 166.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -49.01 -34.89 14.07 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.133 3.773 . . . . 10.0 113.82 176.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -68.71 -16.36 63.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.832 1.049 . . . . 10.0 113.832 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.94 5.13 57.3 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.296 1.279 . . . . 10.0 116.296 165.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.9 pp -61.24 14.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 128.995 2.918 . . . . 10.0 116.706 -173.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 99.9 m 40.6 81.14 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.568 2.747 . . . . 10.0 112.504 155.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -54.6 137.08 44.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.167 1.387 . . . . 10.0 111.692 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.258 0.0 OUTLIER -161.46 -73.72 0.06 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.734 1.383 . . . . 10.0 114.734 -164.006 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -164.68 20.32 0.06 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 121.145 1.793 . . . . 10.0 113.092 -171.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -160.72 -63.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.963 1.305 . . . . 10.0 107.898 -162.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 46.3 p -60.81 -46.82 89.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 126.979 2.112 . . . . 10.0 110.651 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -28.86 66.47 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.932 1.293 . . . . 10.0 112.324 174.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.7 ttm -65.13 -51.13 63.1 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.053 0.541 . . . . 10.0 109.854 173.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -61.56 -46.18 90.99 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.269 1.028 . . . . 10.0 110.352 176.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.29 -53.01 50.31 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 118.585 -0.721 . . . . 10.0 112.799 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -26.44 66.71 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.257 1.389 . . . . 10.0 111.798 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.53 -25.2 45.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.976 1.473 . . . . 10.0 114.976 169.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.46 72.25 1.87 Allowed Pre-proline 0 CA--C 1.563 1.451 0 CA-C-N 119.746 1.157 . . . . 10.0 113.442 -174.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -71.5 -57.54 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.454 2.103 . . . . 10.0 113.283 -161.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.8 mttm -62.6 -27.88 69.5 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 127.081 2.153 . . . . 10.0 112.456 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.28 -46.62 32.38 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 126.284 1.834 . . . . 10.0 110.764 172.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -61.03 -49.29 78.01 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.271 0.841 . . . . 10.0 113.271 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 pt -135.97 131.29 18.86 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.661 0.784 . . . . 10.0 111.155 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -80.75 64.71 8.92 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.228 3.285 . . . . 10.0 113.33 -159.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 149.85 88.67 0.07 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 123.769 0.699 . . . . 10.0 111.59 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 19.0 m -143.89 100.26 3.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.616 1.166 . . . . 10.0 109.407 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -81.35 7.99 10.26 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.383 1.873 . . . . 10.0 115.0 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.3 ttt -50.14 107.55 0.17 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.106 0.866 . . . . 10.0 110.379 156.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.435 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.0 mp -78.49 59.2 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.936 1.295 . . . . 10.0 110.521 -175.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -162.93 92.44 0.77 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.307 1.043 . . . . 10.0 110.358 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.36 -14.62 60.48 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.453 1.649 . . . . 10.0 115.453 -172.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -179.95 159.09 23.22 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.753 1.168 . . . . 10.0 111.19 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' H ' ' A' ' 86' ' ' LYS 0.315 20.5 tt -96.06 -96.29 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 -168.255 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.665 ' H ' HG23 ' A' ' 85' ' ' ILE . 9.3 mmpt? -146.83 103.4 3.63 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.017 1.327 . . . . 10.0 110.995 -171.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 47.22 -73.7 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 129.352 3.061 . . . . 10.0 114.421 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -164.18 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.825 1.65 . . . . 10.0 112.931 157.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 m -52.71 -52.29 56.74 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.771 1.228 . . . . 10.0 112.592 -171.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -58.89 -26.37 64.22 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.984 0.811 . . . . 10.0 112.622 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -23.66 58.18 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.559 0.743 . . . . 10.0 112.251 176.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -70.28 -53.89 14.96 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.085 -1.009 . . . . 10.0 110.101 168.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.08 -47.32 78.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 10.0 110.544 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 45.5 tp -56.93 -48.29 78.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.735 1.614 . . . . 10.0 113.821 172.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 15.4 mm -61.69 -44.36 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 118.858 0.754 . . . . 10.0 109.911 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.22 84.05 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.548 0.739 . . . . 10.0 111.82 175.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -55.62 -60.51 3.33 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.52 0.728 . . . . 10.0 111.756 171.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.77 -21.65 62.48 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.794 1.179 . . . . 10.0 113.99 -172.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.76 -59.77 4.26 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.485 0.714 . . . . 10.0 109.989 159.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 mmtt -61.89 -28.23 69.36 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.36 -1.305 . . . . 10.0 113.387 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.72 -13.92 7.24 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.801 1.637 . . . . 10.0 114.698 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.8 p -74.61 -20.58 59.86 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.882 1.438 . . . . 10.0 114.882 166.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -155.8 15.87 0.36 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 115.175 1.546 . . . . 10.0 115.175 -164.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 115.314 -2.279 . . . . 10.0 113.819 173.636 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 111.013 -0.835 . . . . 10.0 111.013 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.06 151.51 28.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.32 2.248 . . . . 10.0 114.404 -163.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -58.13 -35.62 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 120.763 -1.21 . . . . 10.0 113.228 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 -63.81 -48.89 75.06 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.564 1.546 . . . . 10.0 111.216 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -57.57 -34.11 68.85 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.589 0.755 . . . . 10.0 111.574 172.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.79 -51.61 39.54 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.15 -1.18 . . . . 10.0 110.15 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.259 1.1 ptpm? -64.16 -38.25 90.39 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 118.401 1.101 . . . . 10.0 113.657 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.26 -37.7 78.06 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.595 1.089 . . . . 10.0 113.357 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mm -69.4 -39.99 79.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 120.025 1.284 . . . . 10.0 110.96 172.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -56.38 -49.01 75.69 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.544 -0.723 . . . . 10.0 110.35 174.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.15 -11.59 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.976 1.102 . . . . 10.0 113.976 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -84.95 -33.75 22.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.329 1.051 . . . . 10.0 112.275 -177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -132.02 -63.52 0.81 Allowed 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 126.159 1.784 . . . . 10.0 111.148 -172.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 m -53.64 -47.73 70.05 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.551 1.14 . . . . 10.0 112.784 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.24 -17.57 62.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.046 1.128 . . . . 10.0 114.046 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.01 -7.82 32.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.268 1.427 . . . . 10.0 112.781 174.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -141.67 -21.28 0.74 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.613 1.565 . . . . 10.0 113.186 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -126.23 -5.74 6.62 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -170.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.2 m 54.94 -79.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.934 2.093 . . . . 10.0 116.193 -177.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.8 t 46.95 -59.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.276 1 C-N-CA 131.711 4.004 . . . . 10.0 116.041 -167.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -71.72 14.05 0.23 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.511 1.924 . . . . 10.0 113.687 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -153.78 -166.53 2.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.474 2.71 . . . . 10.0 108.522 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.99 59.97 0.15 Allowed Glycine 0 CA--C 1.541 1.716 0 C-N-CA 125.552 1.548 . . . . 10.0 116.332 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.7 -1.05 1.29 Allowed Glycine 0 CA--C 1.531 1.085 0 N-CA-C 120.709 3.044 . . . . 10.0 120.709 153.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.01 155.35 8.31 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.972 1.386 . . . . 10.0 112.736 -172.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -152.04 133.56 14.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.196 2.199 . . . . 10.0 106.999 -169.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -144.14 -86.86 0.13 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.783 0.833 . . . . 10.0 110.206 -170.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.473 ' O ' HMD3 ' A' ' 105' ' ' HEC . 3.1 m -81.23 -9.48 59.77 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.735 1.214 . . . . 10.0 111.886 177.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -138.8 173.66 22.48 Favored Glycine 0 CA--C 1.544 1.871 0 C-N-CA 126.51 2.005 . . . . 10.0 110.716 162.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 66.9 Cg_endo -71.64 -144.86 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.08 1 C-N-CA 125.379 4.052 . . . . 10.0 109.741 168.193 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -142.81 150.98 40.66 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 119.87 -1.769 . . . . 10.0 110.452 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.62 70.61 7.39 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 81.98 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 10.0 110.234 172.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.1 -67.78 0.48 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.584 2.516 . . . . 10.0 113.303 -176.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.11 -161.68 0.16 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.817 1.647 . . . . 10.0 111.064 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 60.43 64.37 1.22 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.204 1.801 . . . . 10.0 111.422 -173.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.7 42.58 0.86 Allowed Glycine 0 CA--C 1.532 1.151 0 CA-C-N 113.451 -1.704 . . . . 10.0 113.54 -172.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -150.95 150.5 30.89 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.21 1.404 . . . . 10.0 110.668 -177.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 163.59 18.41 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.909 1.077 . . . . 10.0 113.909 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.5 -16.62 58.61 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.278 1.831 . . . . 10.0 113.822 174.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.36 58.41 1.56 Allowed Glycine 0 CA--C 1.536 1.361 0 O-C-N 120.224 -1.547 . . . . 10.0 112.51 170.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -150.31 110.34 4.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.701 2.0 . . . . 10.0 112.238 -170.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.84 157.3 14.01 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.791 1.636 . . . . 10.0 110.376 165.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -84.81 -126.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 124.684 3.589 . . . . 10.0 109.215 159.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.92 79.78 0.37 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.368 1.461 . . . . 10.0 113.48 177.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.403 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 78.6 t80 -144.73 176.4 9.47 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.352 1.861 . . . . 10.0 110.714 172.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 96.7 m -154.39 100.03 2.25 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.881 -1.762 . . . . 10.0 110.832 171.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.61 167.64 16.07 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.338 2.255 . . . . 10.0 112.008 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.8 p -70.7 130.62 42.23 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.125 0.964 . . . . 10.0 111.051 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -33.2 71.86 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.364 1.616 . . . . 10.0 115.364 -162.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.25 -14.57 60.94 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.207 1.188 . . . . 10.0 114.207 -177.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -64.62 -70.06 0.25 Allowed 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.77 1.168 . . . . 10.0 110.244 169.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.16 -41.9 28.13 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.447 1.099 . . . . 10.0 112.104 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.17 -23.66 67.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.835 1.254 . . . . 10.0 114.002 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -74.01 -24.33 59.55 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.26 0.936 . . . . 10.0 112.677 170.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 65.32 12.62 56.22 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 116.844 1.498 . . . . 10.0 116.844 160.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.17 -12.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 129.221 3.008 . . . . 10.0 118.38 -160.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.0 m 56.73 118.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 128.197 2.599 . . . . 10.0 114.006 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 29.0 m95 -75.4 122.17 23.38 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.107 -0.951 . . . . 10.0 112.543 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -163.94 -177.94 5.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 130.207 3.403 . . . . 10.0 107.663 169.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -46.71 -57.94 4.35 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.956 1.253 . . . . 10.0 112.654 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -57.93 15.89 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 130.093 3.357 . . . . 10.0 116.691 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.8 p -158.15 -43.07 0.06 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.221 1.809 . . . . 10.0 109.976 -175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.82 -33.54 60.08 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.735 1.214 . . . . 10.0 113.102 174.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.6 tpp -65.93 -48.96 69.66 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.803 0.729 . . . . 10.0 109.472 174.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.74 -43.87 97.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.634 1.173 . . . . 10.0 109.953 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -58.02 -64.61 0.85 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.224 -0.893 . . . . 10.0 111.719 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -24.4 67.58 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.494 1.497 . . . . 10.0 113.686 -174.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -73.48 -22.87 60.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.745 1.387 . . . . 10.0 114.745 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.98 71.13 2.35 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 120.194 1.361 . . . . 10.0 111.487 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.68 -48.03 0.82 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.225 1.95 . . . . 10.0 111.506 -164.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.7 mtmt -70.28 33.43 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 128.313 2.645 . . . . 10.0 114.097 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -161.91 -39.14 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 127.114 2.165 . . . . 10.0 112.0 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -65.39 -34.21 77.78 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.169 0.44 . . . . 10.0 111.721 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.98 153.25 78.43 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.396 1.078 . . . . 10.0 111.022 171.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.38 93.81 0.75 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.058 3.172 . . . . 10.0 112.757 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.69 49.17 6.25 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.962 0.745 . . . . 10.0 114.962 161.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.1 m -65.39 -19.7 66.06 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.579 1.326 . . . . 10.0 114.579 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 64.87 -45.93 0.34 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.417 2.287 . . . . 10.0 115.653 -176.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.2 ttt 2.7 97.51 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 129.547 3.139 . . . . 10.0 115.393 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . 0.267 9.9 tp -76.12 74.72 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 122.547 1.165 . . . . 10.0 112.237 -178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -162.45 -66.6 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.35 1.86 . . . . 10.0 109.981 170.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.11 -0.56 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 119.927 3.306 . . . . 10.0 119.927 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.17 95.5 0.22 Allowed Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.765 1.621 . . . . 10.0 113.209 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 tp -67.27 159.46 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.904 0.882 . . . . 10.0 112.19 174.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -64.71 -42.03 95.58 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.946 1.298 . . . . 10.0 114.384 -174.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' THR . 3.6 ptpp? -162.97 170.21 18.42 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.585 1.954 . . . . 10.0 109.555 165.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -55.91 -32.1 63.46 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.408 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 12.4 m -56.87 -37.27 71.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.757 1.223 . . . . 10.0 113.235 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -77.19 -15.53 59.46 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.698 1.199 . . . . 10.0 114.147 171.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.477 HH21 HG12 ' A' ' 95' ' ' ILE . 0.0 OUTLIER -76.54 -48.76 18.33 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.237 -1.539 . . . . 10.0 110.866 166.429 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -54.53 -55.47 28.86 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.94 1.296 . . . . 10.0 111.775 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -63.69 -35.48 80.7 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.149 0.796 . . . . 10.0 113.149 -172.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.1 mp -62.08 -42.61 99.38 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.834 1.254 . . . . 10.0 112.687 170.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.477 HG12 HH21 ' A' ' 91' ' ' ARG . 21.8 mm -59.57 -50.89 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.592 0.633 . . . . 10.0 109.754 171.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.62 83.57 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.752 0.821 . . . . 10.0 112.045 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -56.6 -57.49 12.13 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.904 1.282 . . . . 10.0 111.635 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 82.3 mt -70.95 -25.88 62.92 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.927 1.239 . . . . 10.0 112.741 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? -61.07 -29.17 69.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.242 1.017 . . . . 10.0 112.637 165.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -76.54 -51.65 11.29 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 125.145 1.378 . . . . 10.0 110.989 163.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 98' ' ' LEU . . . -54.65 -22.51 13.85 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 121.474 1.943 . . . . 10.0 116.11 -174.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.8 0.73 12.24 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 169.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -153.92 -16.82 0.14 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 128.046 2.538 . . . . 10.0 115.499 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.255 1.356 0 C-N-CA 127.703 2.401 . . . . 10.0 111.792 -163.829 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.473 HMD3 ' O ' ' A' ' 28' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.194 0 CA-C-O 118.217 -1.324 . . . . 10.0 113.642 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -134.55 118.0 16.79 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.627 . . . . 10.0 111.036 -139.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.7 p -50.27 -38.45 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.515 1.126 . . . . 10.0 112.658 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -59.78 -38.73 82.67 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.343 1.457 . . . . 10.0 113.724 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -73.98 -30.45 62.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.448 0.699 . . . . 10.0 110.766 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.47 -50.71 11.13 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 26.98 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.701 2.4 . . . . 10.0 115.146 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.01 -28.5 0.06 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.385 1.474 . . . . 10.0 112.693 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.4 tp -70.19 -37.24 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 120.775 1.625 . . . . 10.0 110.925 161.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -55.54 -51.0 68.53 Favored 'General case' 0 C--N 1.347 0.486 0 O-C-N 121.258 -0.901 . . . . 10.0 110.395 168.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 t -66.89 -8.33 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -96.19 -48.83 5.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.227 1.411 . . . . 10.0 112.169 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -125.07 6.26 7.91 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.668 1.729 . . . . 10.0 115.668 -166.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.4 m -122.61 -44.05 2.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.51 1.924 . . . . 10.0 111.011 172.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.68 -21.59 60.77 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -55.1 -11.61 0.73 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.894 2.078 . . . . 10.0 115.334 169.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.8 m -141.84 -30.22 0.59 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.079 1.752 . . . . 10.0 111.566 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.437 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.3 m-70 -105.89 -20.43 13.44 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.656 1.354 . . . . 10.0 114.656 -176.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.1 p 56.13 12.96 1.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 118.364 2.727 . . . . 10.0 118.364 173.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.402 HG21 ' H ' ' A' ' 32' ' ' LEU . 4.0 t -66.29 165.45 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.273 1.829 . . . . 10.0 112.91 -173.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 87.95 0.15 0.44 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 130.14 3.376 . . . . 10.0 112.905 177.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -151.42 -172.1 4.12 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 128.493 2.717 . . . . 10.0 108.059 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -66.49 68.87 0.16 Allowed Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.221 1.391 . . . . 10.0 112.662 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.9 -171.84 48.31 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 126.095 1.807 . . . . 10.0 114.546 -174.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -163.13 -166.51 1.28 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.86 2.864 . . . . 10.0 109.12 -175.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -152.95 91.84 1.58 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.892 0.877 . . . . 10.0 109.483 -162.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -143.47 2.07 1.24 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.508 1.523 . . . . 10.0 113.146 -165.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m -154.66 -31.21 0.11 Allowed 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.69 -1.257 . . . . 10.0 110.578 164.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.78 163.6 12.17 Favored Glycine 0 CA--C 1.544 1.871 0 N-CA-C 110.951 -0.86 . . . . 10.0 110.951 152.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 40.1 Cg_endo -75.8 0.43 9.23 Favored 'Trans proline' 0 CA--C 1.538 0.683 1 C-N-CA 125.784 4.323 . . . . 10.0 116.571 -175.258 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 64.92 145.34 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.987 2.515 . . . . 10.0 114.056 -163.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' H ' HG21 ' A' ' 20' ' ' VAL . 1.8 mm? -85.26 73.29 10.61 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.225 -0.922 . . . . 10.0 109.493 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -161.93 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.469 0.707 . . . . 10.0 112.271 162.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.21 53.44 0.08 OUTLIER Glycine 0 CA--C 1.54 1.656 0 C-N-CA 127.473 2.463 . . . . 10.0 117.894 -164.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -70.8 177.9 3.37 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.033 2.533 . . . . 10.0 111.094 171.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.288 61.9 m-85 63.02 39.35 10.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.578 1.951 . . . . 10.0 112.24 -161.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.37 45.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.302 0 N-CA-C 116.3 1.28 . . . . 10.0 116.3 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.45 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -152.82 -99.45 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.498 1.649 . . . . 10.0 112.917 174.589 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.45 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -178.35 -165.94 0.1 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 131.563 3.945 . . . . 10.0 107.779 174.346 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.3 t -76.56 -140.7 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.446 1.098 . . . . 10.0 110.228 158.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.4 -69.48 3.36 Favored Glycine 0 CA--C 1.528 0.897 0 O-C-N 120.216 -1.553 . . . . 10.0 112.946 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -64.51 133.58 52.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.617 0.767 . . . . 10.0 111.648 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.85 110.75 0.84 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.93 2.092 . . . . 10.0 108.712 163.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.28 77.59 2.03 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.241 2.627 . . . . 10.0 114.498 -162.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.75 52.46 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.234 1.397 . . . . 10.0 114.587 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -64.16 -59.73 4.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.493 1.917 . . . . 10.0 114.347 -171.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m 77.52 127.07 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.165 2.586 . . . . 10.0 112.691 -164.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.17 -179.41 8.12 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.109 2.564 . . . . 10.0 111.061 -167.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -70.17 158.87 35.0 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.469 -0.769 . . . . 10.0 111.264 168.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.76 -41.98 35.7 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.888 1.811 . . . . 10.0 115.888 -176.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.02 -24.58 47.8 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.926 1.824 . . . . 10.0 115.926 -156.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -60.62 -53.4 57.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.849 0.86 . . . . 10.0 111.614 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.27 20.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.229 1.412 . . . . 10.0 111.926 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -58.1 -29.27 65.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.317 1.447 . . . . 10.0 113.727 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -72.91 -20.82 61.01 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.483 1.038 . . . . 10.0 113.759 178.251 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 59.06 11.08 10.51 Favored Glycine 0 CA--C 1.545 1.937 0 N-CA-C 119.217 2.447 . . . . 10.0 119.217 148.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.9 pt -50.33 -101.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 129.402 3.081 . . . . 10.0 115.796 -170.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -155.1 -27.42 0.11 Allowed 'General case' 0 N--CA 1.48 1.073 0 O-C-N 119.928 -1.733 . . . . 10.0 115.105 -173.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.446 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 0.4 OUTLIER 40.15 95.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.294 2.238 . . . . 10.0 113.757 -159.87 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -163.17 -175.04 4.1 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.267 2.627 . . . . 10.0 109.066 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -44.18 -53.89 6.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.224 2.21 . . . . 10.0 113.124 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.97 19.67 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.303 2.241 . . . . 10.0 116.199 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.3 p -160.05 -45.73 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.364 1.465 . . . . 10.0 110.716 -165.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.74 -22.24 56.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.634 1.174 . . . . 10.0 111.835 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -60.42 3.62 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.571 -0.9 . . . . 10.0 108.571 165.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.2 -37.68 83.86 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 110.538 -0.171 . . . . 10.0 110.538 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -70.43 -51.71 27.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 118.018 -0.991 . . . . 10.0 113.258 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.43 -34.05 76.43 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.356 1.889 . . . . 10.0 113.236 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -72.86 -29.58 63.3 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.101 0.778 . . . . 10.0 113.101 174.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.28 72.43 2.25 Favored Pre-proline 0 CA--C 1.561 1.374 0 N-CA-C 113.695 0.998 . . . . 10.0 113.695 -173.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.39 -50.31 0.73 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.736 2.958 . . . . 10.0 112.887 -165.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.74 -36.11 71.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.64 1.976 . . . . 10.0 112.921 177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -30.29 58.1 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.587 1.555 . . . . 10.0 112.793 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -75.78 -52.92 9.36 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.865 1.061 . . . . 10.0 113.865 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.0 pt -128.93 139.77 36.66 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 118.558 0.617 . . . . 10.0 112.279 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.55 146.89 56.54 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.939 2.426 . . . . 10.0 111.874 -168.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.13 10.84 10.32 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.82 1.2 . . . . 10.0 115.717 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.46 139.22 49.54 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.956 1.878 . . . . 10.0 110.4 175.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -84.8 -61.1 1.86 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 117.214 -1.374 . . . . 10.0 112.675 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.1 ttt 8.84 83.29 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 128.719 2.807 . . . . 10.0 114.098 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.24 74.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.307 1.443 . . . . 10.0 109.911 -171.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -163.15 -52.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.097 0.959 . . . . 10.0 112.911 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 40.15 82.82 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.261 2.225 . . . . 10.0 116.163 172.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.02 105.27 2.86 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.171 0.891 . . . . 10.0 111.781 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.2 tt -62.55 -50.86 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.864 -0.786 . . . . 10.0 112.494 -172.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.0 mttt 161.45 174.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 1 C-N-CA 132.291 4.236 . . . . 10.0 109.299 161.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 10.5 mmpt? 43.64 -98.59 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.962 2.505 . . . . 10.0 112.195 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.85 -49.0 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 129.681 3.192 . . . . 10.0 109.519 173.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 m -49.82 -46.66 51.36 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.736 2.014 . . . . 10.0 112.669 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -56.94 -35.97 69.71 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.108 0.963 . . . . 10.0 112.159 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -41.0 63.4 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.512 0.597 . . . . 10.0 111.032 175.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.04 -47.1 78.5 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 118.724 0.693 . . . . 10.0 111.997 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -57.14 -45.86 83.18 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.534 1.534 . . . . 10.0 111.818 174.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.489 HD21 HMB1 ' A' ' 105' ' ' HEC . 1.1 mp -56.02 -47.15 78.36 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 124.455 1.102 . . . . 10.0 113.364 175.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.5 mm -62.61 -46.06 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 118.355 -0.831 . . . . 10.0 109.145 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.05 82.52 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.966 0.803 . . . . 10.0 112.576 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.02 -63.19 1.17 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.281 1.032 . . . . 10.0 112.572 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.06 -37.63 80.42 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.787 0.835 . . . . 10.0 112.644 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -59.28 -16.94 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.126 0.97 . . . . 10.0 113.392 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -102.61 -45.04 5.16 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 117.529 -1.224 . . . . 10.0 113.725 160.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.58 62.77 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.57 1.692 . . . . 10.0 115.57 -173.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.8 p -72.37 -10.39 59.72 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.869 -1.144 . . . . 10.0 113.931 171.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -154.05 24.77 0.49 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.997 1.719 . . . . 10.0 111.938 -163.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . 0.253 5.4 pt-20 . . . . . 0 C--O 1.248 1.024 0 C-N-CA 126.387 1.875 . . . . 10.0 115.233 -159.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.489 HMB1 HD21 ' A' ' 94' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 110.433 -1.067 . . . . 10.0 110.433 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -150.31 169.72 20.71 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.351 1.46 . . . . 10.0 110.248 -177.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.7 t -58.11 -57.11 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.845 1.258 . . . . 10.0 109.803 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.464 ' OE2' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -62.85 -39.1 93.35 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.117 1.367 . . . . 10.0 113.995 179.255 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.65 -29.79 70.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.236 -0.888 . . . . 10.0 112.345 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -89.83 -43.21 5.17 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 124.92 1.248 . . . . 10.0 112.503 -170.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.464 ' HE2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.544 -0.974 . . . . 10.0 112.606 175.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -35.81 79.59 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.09 -0.957 . . . . 10.0 112.967 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.7 tp -78.2 -33.22 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.728 1.149 . . . . 10.0 110.889 176.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -57.07 -52.9 63.42 Favored 'General case' 0 C--N 1.342 0.263 0 O-C-N 121.224 -0.923 . . . . 10.0 110.437 166.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.4 t -65.8 -9.02 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 O-C-N 121.336 -0.853 . . . . 10.0 113.166 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.96 -37.79 10.05 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.662 1.585 . . . . 10.0 112.047 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptm -124.03 -14.08 7.17 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.817 1.414 . . . . 10.0 114.817 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.5 m -119.86 -39.89 2.8 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.772 1.629 . . . . 10.0 111.725 -172.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.485 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -56.96 -20.23 22.52 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 168.351 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.67 -21.05 2.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.692 1.997 . . . . 10.0 113.602 168.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.0 m -143.13 -28.83 0.55 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.555 1.542 . . . . 10.0 114.759 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.46 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 91.3 m-70 -103.49 -55.73 2.34 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.591 1.33 . . . . 10.0 114.591 -169.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.485 ' H ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 m 35.11 84.35 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.593 2.757 . . . . 10.0 114.173 -168.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.63 -34.09 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.361 1.065 . . . . 10.0 112.545 164.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -95.1 154.8 17.0 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.921 0.711 . . . . 10.0 112.921 -156.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.8 mttp 50.98 -120.84 1.69 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.165 1.386 . . . . 10.0 110.485 176.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.13 62.49 3.34 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.549 1.071 . . . . 10.0 112.405 172.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.58 149.05 51.16 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.202 1.382 . . . . 10.0 114.908 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -162.19 105.36 1.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.859 1.664 . . . . 10.0 111.932 -164.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -67.8 70.19 0.13 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.848 2.059 . . . . 10.0 113.429 176.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.13 -38.95 69.14 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.427 1.491 . . . . 10.0 113.973 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.0 m -153.39 -9.69 0.16 Allowed 'General case' 0 N--CA 1.482 1.158 0 O-C-N 120.769 -1.207 . . . . 10.0 113.189 -171.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.46 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -129.15 172.05 19.81 Favored Glycine 0 CA--C 1.539 1.569 0 N-CA-C 109.525 -1.43 . . . . 10.0 109.525 152.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -71.65 163.58 38.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 120.286 2.043 . . . . 10.0 110.033 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -72.03 7.76 1.52 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.825 1.787 . . . . 10.0 115.825 -167.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mp 40.3 73.68 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.219 1.408 . . . . 10.0 111.587 -165.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -53.34 -164.51 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.894 2.878 . . . . 10.0 113.243 173.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.72 58.72 0.05 OUTLIER Glycine 0 CA--C 1.541 1.658 0 O-C-N 120.011 -1.681 . . . . 10.0 113.149 163.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tp -69.76 -38.47 76.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 128.679 2.792 . . . . 10.0 113.832 -161.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -66.21 95.95 0.32 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.457 1.503 . . . . 10.0 110.29 -175.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.72 13.85 9.99 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.225 1.393 . . . . 10.0 114.678 -173.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.6 ptm85 -150.64 -176.61 5.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.413 2.107 . . . . 10.0 114.74 -175.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -74.6 161.75 29.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.973 2.109 . . . . 10.0 113.837 -163.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.57 -34.74 25.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.56 1.944 . . . . 10.0 113.315 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.92 2.58 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 119.908 -1.745 . . . . 10.0 112.696 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.81 -5.01 1.05 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 118.057 2.614 . . . . 10.0 118.057 -168.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.92 113.75 27.86 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 125.807 1.643 . . . . 10.0 114.424 -167.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -79.22 57.25 6.39 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.552 3.501 . . . . 10.0 113.211 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.59 67.2 0.23 Allowed Glycine 0 N--CA 1.471 1.031 0 C-N-CA 124.527 1.061 . . . . 10.0 112.989 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -144.9 177.76 8.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.352 1.461 . . . . 10.0 109.255 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.2 t -152.77 123.85 7.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.271 1.028 . . . . 10.0 109.686 -177.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' HB2' ' HZ3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -157.19 172.48 18.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.492 1.517 . . . . 10.0 112.705 -159.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.4 p -74.81 107.12 6.7 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.541 -0.725 . . . . 10.0 110.902 177.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -75.21 83.35 2.38 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 122.489 1.138 . . . . 10.0 112.877 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -139.27 -46.21 0.46 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.096 1.758 . . . . 10.0 108.924 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -45.5 -67.04 0.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.373 2.269 . . . . 10.0 111.024 161.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.514 ' HZ3' ' HB2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -57.0 -49.33 76.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.265 0.939 . . . . 10.0 111.727 -178.429 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.69 -17.38 3.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.317 1.847 . . . . 10.0 115.012 173.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.16 60.08 0.29 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.345 0.975 . . . . 10.0 111.002 -169.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.06 -160.39 4.68 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.882 1.706 . . . . 10.0 115.527 173.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.3 pp -169.99 5.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 126.887 2.075 . . . . 10.0 112.698 -150.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.6 m 56.0 118.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.923 2.089 . . . . 10.0 113.645 -163.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -69.53 121.98 18.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.73 -1.231 . . . . 10.0 110.441 168.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -171.03 -179.05 2.63 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.349 1.859 . . . . 10.0 111.439 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -62.06 27.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 131.177 3.791 . . . . 10.0 115.46 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -160.07 9.28 0.1 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.254 2.222 . . . . 10.0 112.089 -167.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.2 p -157.71 -26.78 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.911 -1.118 . . . . 10.0 111.767 -165.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.8 -28.41 60.71 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 117.833 -1.079 . . . . 10.0 112.843 164.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -62.66 -54.3 41.5 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.684 1.129 . . . . 10.0 109.217 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 tp10 -64.07 -41.71 97.25 Favored 'General case' 0 N--CA 1.463 0.195 0 O-C-N 123.527 0.517 . . . . 10.0 110.017 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.64 -48.57 74.33 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.644 -0.693 . . . . 10.0 112.34 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -59.31 -53.96 52.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.288 1.403 . . . . 10.0 110.174 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.39 -18.63 63.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.883 1.438 . . . . 10.0 114.883 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.19 67.45 2.36 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 123.845 0.858 . . . . 10.0 111.803 -176.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.9 -63.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.576 2.851 . . . . 10.0 113.384 -164.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.56 -20.76 65.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.629 1.571 . . . . 10.0 113.473 -178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.88 -51.36 12.67 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.715 2.006 . . . . 10.0 111.275 168.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -60.35 -44.51 95.49 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.83 0.852 . . . . 10.0 112.767 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.34 133.59 20.65 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 124.005 0.922 . . . . 10.0 110.407 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.17 67.75 8.49 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.902 3.068 . . . . 10.0 113.9 -158.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -179.21 -115.31 0.46 Allowed Glycine 0 CA--C 1.524 0.617 0 C-N-CA 124.919 1.247 . . . . 10.0 110.037 167.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.254 36.9 m 67.85 155.89 0.11 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 128.989 2.915 . . . . 10.0 115.013 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mmtt -140.68 19.64 2.35 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.117 1.767 . . . . 10.0 112.601 -175.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.7 ttt -67.78 79.95 0.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.558 1.543 . . . . 10.0 111.398 166.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 71.7 mt -71.14 78.1 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 124.88 1.272 . . . . 10.0 109.87 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -164.09 -40.55 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.022 2.529 . . . . 10.0 110.501 170.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.98 -128.69 1.31 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.299 1.44 . . . . 10.0 112.945 -167.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.59 162.89 53.49 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-O 122.271 0.928 . . . . 10.0 115.131 -162.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.5 tp -80.83 3.91 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 113.757 1.021 . . . . 10.0 113.757 -168.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 62.4 0.65 0.63 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.571 2.348 . . . . 10.0 115.695 172.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -160.37 -144.97 0.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 129.983 3.313 . . . . 10.0 106.847 -163.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.64 -31.73 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 122.953 2.615 . . . . 10.0 117.888 -176.074 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -61.8 -34.52 76.06 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 121.604 2.002 . . . . 10.0 110.931 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.4 pm0 -75.31 -4.43 39.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.914 2.485 . . . . 10.0 114.731 170.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.4 tpm_? -72.45 -58.25 3.54 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 120.77 -1.206 . . . . 10.0 109.852 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -75.57 -29.7 59.42 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 117.076 -1.44 . . . . 10.0 114.29 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 9.6 p30 -65.06 -42.19 94.45 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.789 2.086 . . . . 10.0 112.7 177.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -55.54 -48.27 74.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.753 1.621 . . . . 10.0 112.532 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.7 mm -61.6 -48.1 90.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 118.872 -0.585 . . . . 10.0 109.642 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.3 91.07 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.638 0.775 . . . . 10.0 112.099 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -60.71 -61.93 2.23 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.846 1.258 . . . . 10.0 111.745 173.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.58 -39.73 94.64 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 118.131 -0.938 . . . . 10.0 112.029 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -16.14 63.2 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.694 1.133 . . . . 10.0 113.352 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -89.2 -58.43 2.54 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 124.24 1.016 . . . . 10.0 109.524 162.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.31 -19.1 32.18 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 115.776 1.769 . . . . 10.0 115.776 -173.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 p -65.71 -11.27 43.87 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.35 1.46 . . . . 10.0 114.589 167.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.98 -15.5 0.14 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.198 1.799 . . . . 10.0 115.028 -168.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 . . . . . 0 C--O 1.244 0.81 0 C-N-CA 126.389 1.875 . . . . 10.0 111.523 -170.132 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.988 0 CA-C-O 118.953 -0.915 . . . . 10.0 113.456 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.446 ' HB2' ' HE3' ' A' ' 5' ' ' LYS . 4.7 m-20 -135.34 139.96 44.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.651 1.58 . . . . 10.0 110.778 178.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.6 p -62.98 -43.66 99.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 -172.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.0 mp0 -61.74 -53.01 61.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.904 0.882 . . . . 10.0 110.795 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 2' ' ' ASP . 4.3 mtmp? -60.88 -20.88 62.67 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.922 1.082 . . . . 10.0 113.922 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -91.58 -38.03 5.98 Favored Glycine 0 C--N 1.337 0.62 0 CA-C-N 119.129 0.877 . . . . 10.0 112.647 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -28.51 65.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.103 1.452 . . . . 10.0 112.473 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HZ1' ' CD ' ' A' ' 90' ' ' GLU . 1.6 pttm -60.92 -50.69 72.39 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.826 0.739 . . . . 10.0 111.629 172.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -67.11 -37.16 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 118.515 0.598 . . . . 10.0 110.864 178.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.8 t80 -55.7 -52.0 65.39 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-N 118.082 0.401 . . . . 10.0 110.541 170.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.42 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.4 t -65.95 -11.67 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -95.34 -32.47 12.94 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.89 1.276 . . . . 10.0 112.638 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -122.12 -56.98 1.8 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.883 1.273 . . . . 10.0 111.333 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 12.6 m -67.1 -51.52 53.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.864 1.666 . . . . 10.0 112.6 -171.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.46 -11.03 39.2 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 -172.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.57 -56.42 21.52 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.17 1.388 . . . . 10.0 109.531 166.196 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.3 m -85.25 -37.43 20.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.02 1.328 . . . . 10.0 112.556 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -120.82 44.89 2.37 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 127.079 2.152 . . . . 10.0 112.973 -163.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -57.86 125.19 21.98 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 119.872 -1.768 . . . . 10.0 111.537 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.78 -38.24 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-O 117.248 -1.358 . . . . 10.0 114.518 -168.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -11.84 37.81 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 121.46 1.936 . . . . 10.0 114.605 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -152.02 152.01 31.89 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 128.221 2.608 . . . . 10.0 107.944 167.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.25 -67.08 0.93 Allowed Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.07 1.319 . . . . 10.0 114.504 177.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.02 119.58 1.48 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 124.597 1.094 . . . . 10.0 111.68 -170.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -159.54 166.47 30.75 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.211 1.805 . . . . 10.0 110.233 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -152.7 125.65 8.48 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.523 1.129 . . . . 10.0 112.53 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -144.01 120.0 10.68 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.993 2.117 . . . . 10.0 108.407 176.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.6 m 56.85 -31.41 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.217 1.807 . . . . 10.0 115.56 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.49 159.0 19.99 Favored Glycine 0 CA--C 1.545 1.914 0 CA-C-N 120.941 1.7 . . . . 10.0 112.199 164.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.73 168.87 23.38 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 125.079 3.852 . . . . 10.0 113.537 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.51 123.41 19.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.63 -1.294 . . . . 10.0 108.336 162.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.74 93.27 0.1 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.303 1.041 . . . . 10.0 109.096 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -170.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.261 3.024 . . . . 10.0 113.448 -178.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.89 53.34 0.1 OUTLIER Glycine 0 CA--C 1.541 1.698 0 C-N-CA 126.424 1.964 . . . . 10.0 114.816 172.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mp -68.63 177.58 2.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 129.594 3.158 . . . . 10.0 112.931 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 64.18 59.7 1.03 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.232 1.813 . . . . 10.0 110.504 -166.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.17 16.84 0.26 Allowed Glycine 0 CA--C 1.535 1.283 0 N-CA-C 116.725 1.45 . . . . 10.0 116.725 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.0 ptm85 -152.88 168.78 24.64 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.326 2.063 . . . . 10.0 112.969 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.75 173.86 11.16 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.472 1.909 . . . . 10.0 113.554 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 77.6 p -69.65 172.57 7.24 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.583 1.953 . . . . 10.0 111.541 159.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.35 51.24 4.45 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.201 -0.937 . . . . 10.0 114.603 171.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -11.22 2.85 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.601 1.334 . . . . 10.0 114.601 -164.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.62 140.77 92.3 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 123.35 0.66 . . . . 10.0 112.036 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.03 63.38 8.74 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.558 2.838 . . . . 10.0 112.24 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.24 64.54 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.371 0.986 . . . . 10.0 114.978 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -67.32 170.36 7.38 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 118.424 1.112 . . . . 10.0 112.115 170.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.4 t -152.72 138.35 17.81 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.075 -1.015 . . . . 10.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 -96.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.464 1.506 . . . . 10.0 111.378 -154.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.2 p -142.24 136.89 30.29 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.599 1.559 . . . . 10.0 109.74 167.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -74.75 -31.05 61.69 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.087 -0.506 . . . . 10.0 112.339 177.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.26 -29.83 70.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.505 1.922 . . . . 10.0 113.299 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -72.8 -74.77 0.16 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.48 0.712 . . . . 10.0 109.542 160.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.412 ' HZ1' ' CG ' ' A' ' 50' ' ' ASP 0.307 0.0 OUTLIER -60.24 -31.64 70.39 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.324 1.601 . . . . 10.0 115.324 -157.133 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.37 -22.89 65.55 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.876 1.435 . . . . 10.0 114.876 173.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.67 -36.29 83.22 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.582 1.083 . . . . 10.0 110.797 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.75 13.49 69.68 Favored Glycine 0 CA--C 1.533 1.165 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 165.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.4 pt -51.61 140.47 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 125.931 1.692 . . . . 10.0 111.85 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.1 m -76.13 108.53 9.11 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.418 0.628 . . . . 10.0 109.783 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -69.98 114.89 8.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.947 0.899 . . . . 10.0 111.33 173.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -163.85 -174.53 3.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.316 3.046 . . . . 10.0 109.294 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.22 -54.36 44.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.215 -0.928 . . . . 10.0 111.849 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -62.88 20.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.982 2.913 . . . . 10.0 115.467 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.4 p -158.37 -36.84 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.463 1.905 . . . . 10.0 111.228 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mp -73.92 -30.76 62.74 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 121.051 1.75 . . . . 10.0 112.642 166.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.1 ttm -64.27 -52.62 57.76 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.559 0.618 . . . . 10.0 109.487 175.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.65 -38.41 91.01 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.339 0.656 . . . . 10.0 110.647 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -64.21 -61.9 1.96 Allowed 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.451 -0.785 . . . . 10.0 112.323 175.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.0 tp -66.49 -30.11 70.37 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 120.323 1.42 . . . . 10.0 113.42 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -68.93 -24.49 64.29 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 119.01 0.823 . . . . 10.0 112.809 172.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.25 77.94 2.02 Favored Pre-proline 0 CA--C 1.556 1.208 0 N-CA-C 114.609 1.337 . . . . 10.0 114.609 172.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.79 -41.43 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 121.883 1.722 . . . . 10.0 112.143 -166.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.446 ' HE2' ' CB ' ' A' ' 83' ' ' ALA . 33.3 mttm -67.58 23.28 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.318 2.647 . . . . 10.0 114.777 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.4 mttm -161.36 -31.97 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.555 2.342 . . . . 10.0 111.932 -170.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -68.51 -31.63 71.02 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.276 0.944 . . . . 10.0 113.321 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 pt -135.81 151.84 74.82 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.889 1.276 . . . . 10.0 110.808 177.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.98 22.17 0.49 Allowed 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.29 3.326 . . . . 10.0 115.91 -159.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.4 100.47 0.17 Allowed Glycine 0 CA--C 1.524 0.638 0 O-C-N 121.206 -0.934 . . . . 10.0 112.663 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.32 -27.53 2.42 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.066 1.506 . . . . 10.0 115.066 -172.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.63 -70.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 116.566 -1.683 . . . . 10.0 112.831 -170.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.6 ttt 23.3 92.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 129.535 3.134 . . . . 10.0 113.914 -176.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.8 mt -70.31 70.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 125.741 1.616 . . . . 10.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -162.76 -70.16 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.458 1.903 . . . . 10.0 110.445 169.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.446 ' CB ' ' HE2' ' A' ' 72' ' ' LYS . . . 45.51 87.09 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.72 2.408 . . . . 10.0 116.732 171.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.65 93.63 2.26 Favored Glycine 0 C--N 1.341 0.843 0 C-N-CA 124.472 1.034 . . . . 10.0 111.181 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -66.54 156.24 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 122.34 1.067 . . . . 10.0 113.166 -175.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -59.98 -20.92 60.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.142 2.177 . . . . 10.0 115.356 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -161.51 133.84 5.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.998 2.119 . . . . 10.0 109.392 -165.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.75 -57.33 13.39 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.113 0.965 . . . . 10.0 112.79 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.4 m -50.72 -43.8 57.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.004 1.321 . . . . 10.0 112.278 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.488 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 60.0 mm-40 -59.41 -34.74 72.84 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.394 1.078 . . . . 10.0 112.734 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.471 HH21 HD12 ' A' ' 95' ' ' ILE . 1.3 ttp-105 -70.49 -34.19 72.09 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.127 1.33 . . . . 10.0 112.545 172.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.35 -46.8 72.32 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 174.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -56.57 -52.12 66.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.602 1.561 . . . . 10.0 113.408 171.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 23.3 tp -53.12 -49.44 66.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.714 1.605 . . . . 10.0 113.521 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.471 HD12 HH21 ' A' ' 91' ' ' ARG . 12.1 mt -62.12 -39.28 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-O 119.176 -0.44 . . . . 10.0 110.685 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.44 87.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.562 0.619 . . . . 10.0 112.6 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -56.22 -56.3 22.62 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 117.841 -1.076 . . . . 10.0 111.281 169.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.14 -34.46 78.44 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 120.029 1.286 . . . . 10.0 112.37 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -59.42 -25.52 64.39 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 171.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -93.75 -62.06 1.43 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.741 1.616 . . . . 10.0 112.057 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.96 -11.17 12.03 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.803 1.779 . . . . 10.0 115.803 -164.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 p -81.27 -6.6 59.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -153.56 -10.45 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.187 1.795 . . . . 10.0 114.999 -169.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.249 1.046 0 C-N-CA 127.798 2.439 . . . . 10.0 110.725 -177.413 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 119.46 -0.633 . . . . 10.0 112.002 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -136.65 132.11 34.56 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.118 0.967 . . . . 10.0 111.159 -157.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.48 -54.96 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 125.428 1.491 . . . . 10.0 111.422 -167.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.22 -27.63 66.53 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 115.565 1.691 . . . . 10.0 115.565 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -64.23 -42.6 96.49 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.337 0.517 . . . . 10.0 109.611 163.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.56 -41.98 49.34 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 124.348 0.975 . . . . 10.0 111.377 -170.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -45.17 -59.62 2.54 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 126.987 2.115 . . . . 10.0 111.287 173.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -71.89 -42.3 66.95 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.314 1.046 . . . . 10.0 112.085 -172.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.84 -37.46 79.93 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 118.767 0.712 . . . . 10.0 111.351 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -56.02 -52.24 64.93 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 119.107 0.867 . . . . 10.0 110.107 167.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.414 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.5 t -61.36 -14.33 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -92.52 -38.51 11.89 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.472 1.509 . . . . 10.0 112.169 -177.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -130.23 0.09 4.61 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.769 1.766 . . . . 10.0 115.769 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.1 m -131.8 -43.48 0.99 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.241 1.417 . . . . 10.0 112.592 -176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.64 -25.52 67.4 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.135 -0.978 . . . . 10.0 112.821 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -1.57 0.24 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.542 2.337 . . . . 10.0 114.791 170.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.3 m -143.16 -33.16 0.45 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.004 2.122 . . . . 10.0 112.468 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -115.25 -10.21 12.13 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.018 1.727 . . . . 10.0 115.271 -174.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 p 57.6 -68.17 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 128.661 2.784 . . . . 10.0 117.487 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.3 t 39.22 -96.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 128.954 2.902 . . . . 10.0 112.33 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -65.74 -17.46 64.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.472 1.109 . . . . 10.0 112.605 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -80.39 59.53 3.49 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.604 -1.31 . . . . 10.0 110.974 166.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.75 -58.78 3.01 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.1 1.81 . . . . 10.0 114.633 173.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.74 116.94 2.07 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 124.369 0.985 . . . . 10.0 113.704 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -163.55 172.83 13.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 128.74 2.816 . . . . 10.0 109.196 177.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -152.74 67.68 0.82 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.875 0.87 . . . . 10.0 110.977 -165.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.7 mtpt -96.05 -78.73 0.46 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.808 1.243 . . . . 10.0 111.884 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.436 ' O ' HMD3 ' A' ' 105' ' ' HEC . 1.3 m -81.11 -25.75 36.73 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.373 0.508 . . . . 10.0 112.373 -175.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -132.8 173.86 20.74 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 125.583 1.563 . . . . 10.0 110.286 162.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.476 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 84.8 Cg_endo -72.21 161.22 45.17 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.36 2.04 . . . . 10.0 110.609 172.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.96 125.08 23.78 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.985 -1.072 . . . . 10.0 109.711 166.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -77.34 74.76 3.9 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 163.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -170.83 0.14 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 10.0 109.503 158.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -32.45 114.44 0.08 OUTLIER Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.13 0.871 . . . . 10.0 112.421 163.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 tp -136.56 -46.79 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.462 1.505 . . . . 10.0 112.054 -174.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.592 ' HB2' HG21 ' A' ' 102' ' ' THR . 2.5 m-85 -71.0 109.58 5.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.434 0.693 . . . . 10.0 109.953 -168.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.25 4.29 90.25 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 118.661 -1.077 . . . . 10.0 113.865 -174.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mtp85 -81.45 -97.28 0.04 OUTLIER 'General case' 0 C--N 1.347 0.478 0 CA-C-O 116.946 -1.502 . . . . 10.0 109.087 169.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -152.42 -119.95 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 120.578 1.536 . . . . 10.0 110.744 174.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.6 m -148.7 165.85 30.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.468 3.107 . . . . 10.0 106.967 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 68.46 -3.58 5.95 Favored Glycine 0 CA--C 1.529 0.917 0 N-CA-C 118.763 2.265 . . . . 10.0 118.763 156.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.23 125.38 26.5 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.603 1.961 . . . . 10.0 111.236 174.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.71 157.38 16.33 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.88 1.672 . . . . 10.0 108.732 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -83.84 -119.24 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 124.005 3.137 . . . . 10.0 109.897 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.99 74.8 0.95 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.915 1.245 . . . . 10.0 113.084 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.476 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 51.0 t80 -144.56 107.24 4.43 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.019 1.327 . . . . 10.0 111.791 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.5 m -79.77 95.32 5.96 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.773 1.229 . . . . 10.0 111.539 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.05 173.19 11.32 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.356 0.872 . . . . 10.0 113.356 169.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.4 p -69.31 -5.05 20.66 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 128.66 2.784 . . . . 10.0 115.616 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 t70 47.42 -169.46 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.384 1.874 . . . . 10.0 114.046 -159.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.23 -42.82 0.1 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.374 3.07 . . . . 10.0 115.307 -166.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -61.29 2.72 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.838 1.255 . . . . 10.0 111.079 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -43.23 55.18 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 127.315 2.246 . . . . 10.0 112.375 168.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -18.22 65.19 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 115.447 1.647 . . . . 10.0 115.447 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.96 -32.29 61.68 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.093 0.86 . . . . 10.0 111.174 170.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.17 28.43 73.68 Favored Glycine 0 CA--C 1.537 1.466 0 N-CA-C 116.277 1.271 . . . . 10.0 116.277 162.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -7.55 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 127.343 2.257 . . . . 10.0 116.584 -173.19 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.4 m 57.62 108.47 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.695 2.398 . . . . 10.0 114.384 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -66.62 135.07 53.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.18 1.392 . . . . 10.0 110.624 172.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 163.23 -72.5 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 129.875 3.27 . . . . 10.0 107.692 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -44.82 -61.77 1.47 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.548 1.939 . . . . 10.0 111.477 -178.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 2.3 p -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 127.611 2.364 . . . . 10.0 112.22 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -32.92 60.23 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.105 0.962 . . . . 10.0 113.449 177.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 6.8 ttm -62.83 -52.9 61.35 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 170.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -64.97 -38.19 90.15 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.226 1.41 . . . . 10.0 111.025 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -60.83 -64.09 1.08 Allowed 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.208 1.003 . . . . 10.0 110.716 170.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.432 HD11 HMB2 ' A' ' 105' ' ' HEC . 84.0 mt -58.72 -32.15 68.94 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.611 1.096 . . . . 10.0 112.67 -175.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.4 -35.33 69.89 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.669 1.359 . . . . 10.0 114.669 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -162.39 80.49 1.81 Allowed Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 119.811 1.187 . . . . 10.0 111.543 173.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.7 -44.68 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.413 2.076 . . . . 10.0 112.174 -160.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -60.14 -34.78 74.02 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 127.209 2.204 . . . . 10.0 113.359 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -76.3 -41.41 48.71 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 119.061 -0.495 . . . . 10.0 111.489 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -69.88 -39.25 76.4 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.649 1.351 . . . . 10.0 114.649 -171.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 21.0 pt -135.17 144.02 48.25 Favored Pre-proline 0 N--CA 1.473 0.696 0 CA-C-N 118.811 0.732 . . . . 10.0 111.458 172.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -69.3 163.87 36.28 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.192 2.594 . . . . 10.0 111.083 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.15 -22.82 0.16 Allowed Glycine 0 CA--C 1.535 1.323 0 N-CA-C 116.344 1.298 . . . . 10.0 116.344 176.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.73 118.63 5.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 120.053 1.926 . . . . 10.0 109.745 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -87.12 -71.08 0.58 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.871 0.868 . . . . 10.0 110.683 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.4 ttp 28.61 101.17 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 129.892 3.277 . . . . 10.0 113.987 -176.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.6 tp -64.2 54.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 128.871 2.868 . . . . 10.0 114.407 -174.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -163.4 -176.08 4.56 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.542 2.337 . . . . 10.0 110.697 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.51 -155.82 0.34 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.867 2.467 . . . . 10.0 109.763 -173.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.68 44.06 0.15 Allowed Glycine 0 CA--C 1.536 1.354 0 C-N-CA 128.193 2.806 . . . . 10.0 117.656 -170.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.442 HG23 ' H ' ' A' ' 86' ' ' LYS 0.368 7.4 tt 42.96 -112.19 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 128.833 2.853 . . . . 10.0 113.036 -177.45 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.442 ' H ' HG23 ' A' ' 85' ' ' ILE . 53.9 tttm -149.7 -69.65 0.2 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.157 1.799 . . . . 10.0 113.259 173.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.474 ' HE3' ' H ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -76.74 148.04 36.96 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.486 1.039 . . . . 10.0 110.684 173.255 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -58.55 -36.84 74.52 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.11 -0.369 . . . . 10.0 111.619 169.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 m -55.94 -53.81 52.3 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 124.774 1.23 . . . . 10.0 110.062 176.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -57.76 -39.4 77.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.832 0.853 . . . . 10.0 111.771 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -59.2 -50.51 73.76 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 118.764 -0.636 . . . . 10.0 111.709 175.109 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -58.19 -52.63 64.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.392 1.077 . . . . 10.0 111.539 172.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -55.81 -47.78 76.56 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 126.841 2.056 . . . . 10.0 111.465 -170.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.56 -43.8 93.48 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.4 mm -65.45 -44.26 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 118.948 -0.549 . . . . 10.0 110.528 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.38 85.74 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.649 0.779 . . . . 10.0 112.163 175.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.403 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 1.1 t80 -57.21 -55.07 39.54 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.061 1.344 . . . . 10.0 111.443 171.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 22.6 mt -63.29 -34.7 78.25 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 118.436 -0.792 . . . . 10.0 112.618 -177.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -59.98 -20.79 59.54 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.941 1.296 . . . . 10.0 113.462 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -92.87 -50.68 5.44 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.73 1.212 . . . . 10.0 112.196 165.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.04 -22.85 63.17 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 120.21 1.368 . . . . 10.0 114.567 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 36' ' ' PHE . 14.6 t -76.55 6.4 5.89 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.586 1.954 . . . . 10.0 114.489 169.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -151.37 -42.35 0.12 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.855 1.662 . . . . 10.0 113.685 -166.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 115.987 -1.959 . . . . 10.0 115.224 -179.184 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.436 HMD3 ' O ' ' A' ' 28' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.608 -1.106 . . . . 10.0 113.51 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -118.12 154.5 32.02 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.776 1.63 . . . . 10.0 112.143 166.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.92 -52.15 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.21 1.404 . . . . 10.0 111.886 171.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -47.36 71.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 124.277 1.031 . . . . 10.0 113.469 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.58 -15.66 58.72 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.961 0.8 . . . . 10.0 112.204 172.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.21 -48.96 3.4 Favored Glycine 0 C--N 1.34 0.773 0 C-N-CA 125.224 1.393 . . . . 10.0 112.318 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.416 ' HB3' ' CD1' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -63.88 -35.12 79.6 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 122.264 -0.55 . . . . 10.0 112.478 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -39.18 90.01 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.441 0.904 . . . . 10.0 113.441 174.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -33.89 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.615 1.098 . . . . 10.0 111.079 175.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -55.98 -52.07 65.49 Favored 'General case' 0 C--N 1.342 0.244 0 O-C-N 121.435 -0.791 . . . . 10.0 110.454 167.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.9 t -63.67 -11.41 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 113.632 0.975 . . . . 10.0 113.632 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -85.32 -48.0 9.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.271 1.028 . . . . 10.0 111.337 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -136.07 4.85 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 -168.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.5 m -116.74 -41.6 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.439 1.496 . . . . 10.0 111.215 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.64 -27.07 57.66 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.538 0.94 . . . . 10.0 113.538 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -55.34 -15.21 2.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.882 2.073 . . . . 10.0 115.571 172.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 69.4 m -142.09 -14.32 0.8 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.237 1.415 . . . . 10.0 112.673 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -128.44 -13.45 4.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.845 1.424 . . . . 10.0 114.845 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.3 t 39.46 11.62 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 120.352 3.464 . . . . 10.0 120.352 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.0 p -63.82 -16.02 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 N-CA-C 117.053 2.242 . . . . 10.0 117.053 -160.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.03 6.83 4.71 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.251 1.387 . . . . 10.0 112.443 169.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -152.02 -173.26 4.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.188 2.995 . . . . 10.0 107.941 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.63 134.18 39.06 Favored Glycine 0 CA--C 1.533 1.168 0 O-C-N 121.057 -1.027 . . . . 10.0 112.113 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.05 54.12 3.83 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.502 1.525 . . . . 10.0 116.888 -168.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 25' ' ' LYS . 1.4 mppt? -62.2 91.28 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.506 1.123 . . . . 10.0 110.566 170.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -69.17 66.14 0.16 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.983 1.313 . . . . 10.0 112.523 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -95.05 116.98 29.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.69 1.596 . . . . 10.0 108.097 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 m 57.68 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 127.428 2.291 . . . . 10.0 116.568 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -134.68 148.46 19.53 Favored Glycine 0 CA--C 1.547 2.065 0 CA-C-N 121.902 2.137 . . . . 10.0 113.724 165.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -82.27 68.08 7.89 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.064 3.176 . . . . 10.0 112.395 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 p30 47.73 -11.46 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.495 1 N-CA-C 122.121 4.119 . . . . 10.0 122.121 157.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . 0.315 5.0 mp 55.28 37.37 28.8 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 128.755 2.822 . . . . 10.0 117.158 -175.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.67 108.22 0.29 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.945 1.698 . . . . 10.0 113.954 164.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.27 35.17 49.42 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 116.187 1.235 . . . . 10.0 116.187 158.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.424 ' CD2' HMA3 ' A' ' 105' ' ' HEC . 6.8 mp -58.78 -175.85 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 126.505 1.922 . . . . 10.0 111.696 168.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 60.39 64.97 1.12 Allowed 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.336 -1.478 . . . . 10.0 112.855 -173.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.59 -35.28 2.51 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.591 2.043 . . . . 10.0 112.886 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.544 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -66.79 154.41 40.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.335 1.054 . . . . 10.0 110.488 169.469 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -62.87 177.97 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.875 1.67 . . . . 10.0 111.963 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.71 156.17 31.25 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.12 -0.988 . . . . 10.0 109.731 158.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.44 -116.21 4.35 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.249 -0.907 . . . . 10.0 112.926 169.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 54.64 -7.38 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.268 2.227 . . . . 10.0 116.766 -172.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.42 158.59 10.51 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.327 2.651 . . . . 10.0 113.349 176.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.53 -175.25 1.04 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.144 2.562 . . . . 10.0 111.002 161.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.99 28.36 0.07 OUTLIER Glycine 0 CA--C 1.541 1.688 0 C-N-CA 127.492 2.472 . . . . 10.0 118.015 -173.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.27 128.06 34.16 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.917 1.687 . . . . 10.0 109.707 166.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 m -73.46 125.04 27.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.175 0.99 . . . . 10.0 112.489 -174.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.412 ' HB2' ' HZ3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -140.08 178.15 7.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.536 1.934 . . . . 10.0 112.572 -175.705 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.0 p -85.93 106.24 16.98 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.169 0.895 . . . . 10.0 110.856 166.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -56.29 -29.49 61.25 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.863 1.801 . . . . 10.0 115.863 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.82 -54.94 31.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.87 1.268 . . . . 10.0 112.094 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -47.27 -55.98 7.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.746 1.618 . . . . 10.0 111.82 174.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.466 ' HZ1' ' CGD' ' A' ' 105' ' ' HEC . 0.2 OUTLIER -57.0 -57.25 13.35 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.571 0.748 . . . . 10.0 110.924 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -65.6 -22.74 66.7 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.489 0.922 . . . . 10.0 113.489 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -20.99 66.38 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.135 0.88 . . . . 10.0 112.858 171.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.06 11.58 63.89 Favored Glycine 0 CA--C 1.535 1.336 0 N-CA-C 116.076 1.191 . . . . 10.0 116.076 164.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.28 -6.29 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 128.643 2.777 . . . . 10.0 117.236 -171.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 84.9 m 58.38 117.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.65 2.78 . . . . 10.0 115.665 171.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 21.6 m95 -76.0 120.73 21.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.861 -1.063 . . . . 10.0 112.644 -175.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.37 179.21 5.12 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.262 2.225 . . . . 10.0 110.605 -176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.75 -13.24 62.18 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.248 1.419 . . . . 10.0 114.754 -169.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.02 -58.61 3.18 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.505 1.145 . . . . 10.0 111.406 163.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.6 p -75.19 -37.32 61.25 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.728 1.611 . . . . 10.0 112.882 -165.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.02 -11.71 59.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.965 1.306 . . . . 10.0 113.938 172.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -65.95 0.61 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 106.878 -1.527 . . . . 10.0 106.878 158.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -45.53 70.56 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.431 1.092 . . . . 10.0 111.332 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -66.64 -56.05 12.46 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.463 0.912 . . . . 10.0 113.463 -177.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -27.5 65.62 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.584 1.538 . . . . 10.0 112.36 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -66.55 -38.06 86.31 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 120.197 1.362 . . . . 10.0 114.227 169.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -162.81 100.13 1.06 Allowed Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 119.885 1.221 . . . . 10.0 111.672 166.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.435 ' HB2' HG21 ' A' ' 78' ' ' THR . 58.3 Cg_endo -71.69 -46.48 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.271 1.981 . . . . 10.0 111.493 -168.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -70.03 -22.36 63.1 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.224 1.81 . . . . 10.0 113.293 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -72.44 -53.93 10.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.716 0.806 . . . . 10.0 110.43 163.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -58.99 -41.0 86.54 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.42 155.27 64.28 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 124.228 1.011 . . . . 10.0 111.852 170.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.36 150.6 52.78 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.56 2.173 . . . . 10.0 113.193 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.87 -100.44 2.52 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.089 2.28 . . . . 10.0 111.208 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 71' ' ' PRO 0.289 96.9 m 34.65 90.43 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 130.731 3.612 . . . . 10.0 116.058 -176.075 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -73.31 19.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.853 1.427 . . . . 10.0 114.853 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.5 ttt -70.29 78.16 0.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.158 -0.964 . . . . 10.0 108.932 164.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 25.9 mm -69.51 78.56 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 125.0 1.32 . . . . 10.0 109.654 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -162.73 -72.42 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.52 1.128 . . . . 10.0 111.935 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -70.6 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.268 2.627 . . . . 10.0 116.439 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.17 86.78 0.11 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 126.621 2.058 . . . . 10.0 113.828 -166.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.406 ' CD1' HD22 ' A' ' 94' ' ' LEU . 21.1 tt -63.28 -53.99 38.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 115.108 1.521 . . . . 10.0 115.108 -163.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 163.58 -169.8 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 1 C-N-CA 131.821 4.049 . . . . 10.0 109.138 -175.742 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.435 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.64 -70.21 0.11 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.924 2.489 . . . . 10.0 114.207 -162.615 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.71 -51.5 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.502 1.297 . . . . 10.0 114.502 -173.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -46.87 88.26 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.439 1.018 . . . . 10.0 110.525 -175.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -60.27 -33.71 72.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.937 1.695 . . . . 10.0 112.179 -172.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.9 -43.94 97.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.009 2.124 . . . . 10.0 112.476 172.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.71 -43.44 65.9 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.896 1.278 . . . . 10.0 110.565 174.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -58.24 -44.09 88.13 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.689 1.196 . . . . 10.0 110.376 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.493 HD21 HMB1 ' A' ' 105' ' ' HEC . 1.0 OUTLIER -52.61 -47.63 66.85 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.229 1.196 . . . . 10.0 114.229 171.567 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.94 -47.22 89.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.62 82.16 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.648 0.779 . . . . 10.0 112.319 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.416 ' CD1' ' HB3' ' A' ' 7' ' ' LYS . 3.6 t80 -65.01 -63.23 1.16 Allowed 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.611 1.164 . . . . 10.0 112.017 171.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.43 -33.27 75.56 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.262 -0.875 . . . . 10.0 112.419 -170.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.55 -14.48 42.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.642 1.177 . . . . 10.0 113.311 172.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -95.29 -58.95 2.0 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.421 1.089 . . . . 10.0 110.952 161.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.81 -16.63 17.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 116.429 2.011 . . . . 10.0 116.429 -168.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.5 p -74.96 -4.54 38.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.844 1.424 . . . . 10.0 114.844 168.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -153.32 -22.24 0.15 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.062 1.745 . . . . 10.0 114.465 -167.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 C--O 1.249 1.035 0 C-N-CA 126.872 2.069 . . . . 10.0 111.059 -160.933 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.497 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.667 0 CA-C-O 118.924 -0.931 . . . . 10.0 112.326 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.07 140.93 36.22 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.087 0.944 . . . . 10.0 112.816 -149.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.436 HG11 ' HG3' ' A' ' 100' ' ' LYS . 0.1 OUTLIER -55.35 -50.05 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.837 2.055 . . . . 10.0 113.223 178.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mp0 -64.44 -32.94 74.77 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.373 -0.829 . . . . 10.0 111.639 -174.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -76.02 -12.38 60.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.031 1.732 . . . . 10.0 112.842 172.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.75 -48.01 3.53 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 124.21 0.91 . . . . 10.0 111.269 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -49.98 -44.34 50.79 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.161 0.98 . . . . 10.0 112.831 174.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.432 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -67.26 -12.86 61.21 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.883 1.673 . . . . 10.0 114.328 -177.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.432 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 8.1 tp -114.78 -28.03 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.689 0.796 . . . . 10.0 112.204 174.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -55.58 -52.91 62.17 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.224 1.01 . . . . 10.0 110.456 163.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.33 -12.8 9.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.936 0.717 . . . . 10.0 112.936 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.25 -70.23 0.72 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.919 1.288 . . . . 10.0 109.43 172.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -80.48 -11.14 59.71 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.228 1.566 . . . . 10.0 115.228 -168.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 m -124.46 -48.13 1.83 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.649 1.179 . . . . 10.0 111.735 -171.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.31 -13.2 57.94 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.658 0.985 . . . . 10.0 113.658 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -55.35 -14.15 1.74 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.858 1.663 . . . . 10.0 114.143 162.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.3 m -142.74 -25.03 0.63 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.803 2.041 . . . . 10.0 113.134 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.431 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 81.9 m-70 -126.74 77.17 1.7 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 127.145 2.178 . . . . 10.0 112.154 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 t -75.17 46.52 0.32 Allowed 'General case' 0 CA--C 1.557 1.249 0 O-C-N 120.182 -1.574 . . . . 10.0 114.494 -175.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.72 -51.46 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.802 1.641 . . . . 10.0 113.218 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -53.42 -45.26 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.719 1.208 . . . . 10.0 111.52 -171.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -86.17 7.24 25.8 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.63 1.572 . . . . 10.0 113.198 -176.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 23.02 78.15 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.535 1.064 . . . . 10.0 114.521 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.75 169.54 48.9 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.885 1.342 . . . . 10.0 112.462 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -70.82 153.64 42.56 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.364 0.602 . . . . 10.0 111.107 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.65 135.47 54.13 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.609 156.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -144.39 -76.55 0.23 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.611 1.164 . . . . 10.0 110.776 -175.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.1 m -76.35 -55.99 5.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.634 0.774 . . . . 10.0 110.039 169.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.72 167.36 16.32 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 123.835 0.731 . . . . 10.0 111.904 169.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 45.7 Cg_endo -68.3 166.3 25.81 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.27 3.313 . . . . 10.0 110.921 169.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -85.19 139.97 31.26 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.664 -1.235 . . . . 10.0 107.664 164.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.7 74.8 5.22 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.587 -0.894 . . . . 10.0 108.587 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 73.66 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.557 3.143 . . . . 10.0 113.159 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.27 -68.73 0.06 OUTLIER Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.506 2.479 . . . . 10.0 111.443 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.451 ' C ' HH11 ' A' ' 38' ' ' ARG 0.288 6.9 tp 112.06 -122.79 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.483 1 C-N-CA 132.529 4.331 . . . . 10.0 109.322 167.002 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 72.0 m-85 32.72 64.81 0.25 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.731 2.412 . . . . 10.0 116.731 167.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.25 -42.24 1.73 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.915 2.198 . . . . 10.0 115.023 172.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.451 HH11 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -64.62 11.0 0.06 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 120.363 3.468 . . . . 10.0 120.363 -158.567 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.9 mttt 79.03 147.2 0.09 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.527 3.131 . . . . 10.0 113.379 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -71.78 -40.65 69.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.605 1.562 . . . . 10.0 111.949 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.0 56.66 1.43 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 126.223 1.868 . . . . 10.0 113.251 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -129.95 -22.75 2.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 -173.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.18 105.13 0.48 Allowed Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 126.067 1.747 . . . . 10.0 113.538 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -79.97 62.32 8.48 Favored 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.11 3.207 . . . . 10.0 114.085 -163.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.13 60.63 0.18 Allowed Glycine 0 N--CA 1.471 1.027 0 C-N-CA 124.891 1.234 . . . . 10.0 112.341 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -143.63 170.75 15.25 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.545 1.538 . . . . 10.0 109.748 -169.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.6 t -152.84 153.6 33.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 122.08 0.943 . . . . 10.0 110.946 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -155.26 -105.14 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.737 -1.119 . . . . 10.0 110.369 -150.552 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 50.3 p -141.78 9.44 1.97 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.352 1.061 . . . . 10.0 112.859 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 48.95 -50.14 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.553 3.141 . . . . 10.0 115.009 -159.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.47 -41.22 9.24 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.725 2.01 . . . . 10.0 113.192 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -48.57 -60.9 2.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.514 1.526 . . . . 10.0 112.843 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -75.35 -33.7 61.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.171 0.988 . . . . 10.0 112.12 179.082 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.71 -32.8 74.34 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.429 1.092 . . . . 10.0 113.488 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -50.58 73.51 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.898 0.772 . . . . 10.0 110.357 172.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.84 128.54 0.55 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 123.46 0.553 . . . . 10.0 113.59 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.411 HD13 ' CE2' ' A' ' 59' ' ' TRP . 0.9 OUTLIER -170.71 13.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 126.952 2.101 . . . . 10.0 112.375 -162.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.6 m 44.92 56.58 5.23 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.303 1.441 . . . . 10.0 114.238 152.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.411 ' CE2' HD13 ' A' ' 57' ' ' ILE . 40.3 m95 -52.43 135.82 32.73 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -163.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 15.2 pttp -177.72 -167.47 0.15 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 130.702 3.601 . . . . 10.0 110.579 -168.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -68.74 32.81 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.301 2.641 . . . . 10.0 116.713 -159.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.21 -57.67 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.392 -1.442 . . . . 10.0 111.784 -169.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.4 p -53.63 -44.54 69.62 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 130.942 3.697 . . . . 10.0 111.479 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.9 mp -65.18 -32.98 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.436 1.016 . . . . 10.0 113.37 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.9 mtm -75.24 -25.99 58.53 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 120.116 1.325 . . . . 10.0 111.84 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -75.52 -47.58 26.3 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 118.929 0.786 . . . . 10.0 111.708 162.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.68 -43.33 89.61 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 114.009 1.114 . . . . 10.0 114.009 -173.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -64.36 -41.35 96.78 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.326 1.421 . . . . 10.0 111.68 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -68.6 -28.76 67.21 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.902 1.075 . . . . 10.0 113.902 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -161.34 86.88 1.66 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.731 1.212 . . . . 10.0 111.276 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.07 -48.17 5.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.355 2.037 . . . . 10.0 113.694 -169.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -69.98 -19.36 63.35 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.177 1.391 . . . . 10.0 113.036 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.38 -47.75 46.97 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.493 1.117 . . . . 10.0 110.191 167.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -71.98 -40.75 68.35 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.643 0.979 . . . . 10.0 113.643 -174.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.0 pt -135.79 126.7 16.98 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.345 1.058 . . . . 10.0 109.324 170.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -70.77 148.84 59.41 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.455 2.103 . . . . 10.0 111.261 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 47.37 66.75 1.76 Allowed Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.066 1.317 . . . . 10.0 113.124 176.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.2 t -123.61 23.27 8.89 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.216 1.406 . . . . 10.0 113.918 -169.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt 47.83 -88.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.181 2.192 . . . . 10.0 113.631 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt 15.21 90.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 131.019 3.728 . . . . 10.0 113.82 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.515 ' H ' HD12 ' A' ' 81' ' ' ILE . 2.6 mp -74.52 54.89 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 126.733 2.013 . . . . 10.0 110.139 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -163.28 66.63 0.19 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.411 1.885 . . . . 10.0 109.709 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.39 112.19 11.45 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.157 0.983 . . . . 10.0 110.408 172.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.26 175.13 32.99 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.766 1.204 . . . . 10.0 113.612 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -143.92 149.47 17.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.317 -1.364 . . . . 10.0 107.317 157.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -66.83 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.277 1.031 . . . . 10.0 113.185 -166.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -77.05 120.99 22.92 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.037 -1.097 . . . . 10.0 108.037 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -63.66 -16.46 61.04 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.073 1.306 . . . . 10.0 113.999 -174.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 m -55.48 -34.94 65.0 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.948 . . . . 10.0 112.421 163.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.19 -38.63 88.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.97 1.308 . . . . 10.0 111.181 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -60.87 -50.71 72.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.626 1.17 . . . . 10.0 110.938 175.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.56 -53.16 61.52 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.459 1.103 . . . . 10.0 111.886 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -56.66 -44.09 81.02 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.315 1.446 . . . . 10.0 110.617 -175.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mp -60.32 -45.65 92.65 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.189 1.181 . . . . 10.0 114.189 175.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mm -61.04 -48.59 88.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.91 73.68 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.76 0.424 . . . . 10.0 111.549 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.402 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.1 t80 -51.46 -59.1 4.62 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.792 1.637 . . . . 10.0 112.754 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.402 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 48.1 mt -68.45 -36.08 78.51 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.224 0.92 . . . . 10.0 112.15 -178.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -32.46 74.02 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.654 0.661 . . . . 10.0 112.302 178.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HG3' HG11 ' A' ' 3' ' ' VAL . 3.0 mmmp? -72.8 -52.6 14.3 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.333 1.453 . . . . 10.0 112.242 165.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.79 -27.98 45.59 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.898 1.444 . . . . 10.0 114.898 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.6 t -76.49 2.78 12.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 115.643 1.719 . . . . 10.0 115.643 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -151.32 -1.84 0.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.026 1.491 . . . . 10.0 115.026 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 127.525 2.33 . . . . 10.0 114.488 175.669 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.491 HMD1 ' O1D' ' A' ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.179 -0.768 . . . . 10.0 111.179 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.53 135.16 49.96 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.423 0.689 . . . . 10.0 112.645 -155.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.28 -50.61 70.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 125.749 1.62 . . . . 10.0 111.438 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.83 -40.1 87.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.681 1.592 . . . . 10.0 114.084 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.79 -26.48 68.37 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.751 0.82 . . . . 10.0 112.514 169.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.54 -52.02 4.64 Favored Glycine 0 C--N 1.335 0.499 0 N-CA-C 110.281 -1.128 . . . . 10.0 110.281 -178.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.23 38.7 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.769 2.027 . . . . 10.0 114.709 176.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -42.16 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.713 2.405 . . . . 10.0 110.988 175.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 tp -74.83 -33.96 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 119.796 1.18 . . . . 10.0 111.426 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -56.25 -51.12 69.29 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-O 121.25 0.548 . . . . 10.0 109.889 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.7 t -65.19 -9.43 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.543 0.737 . . . . 10.0 112.539 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -94.56 -58.59 2.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.436 1.494 . . . . 10.0 111.038 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -116.99 8.74 13.49 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 116.236 1.939 . . . . 10.0 116.236 -168.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.8 m -118.81 -46.55 2.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.074 1.35 . . . . 10.0 110.842 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.02 62.58 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.05 1.13 . . . . 10.0 114.05 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.28 -12.12 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.757 1.223 . . . . 10.0 114.146 165.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.8 m -143.22 -17.57 0.65 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.083 1.753 . . . . 10.0 114.091 -176.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -132.51 102.07 5.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.699 2.0 . . . . 10.0 112.731 -175.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -67.15 24.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 128.988 2.915 . . . . 10.0 116.943 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.8 p -64.58 -39.33 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 120.404 -1.435 . . . . 10.0 114.483 -168.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -59.9 -14.45 15.53 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.011 1.724 . . . . 10.0 115.064 -160.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -150.31 13.05 0.75 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.1 2.16 . . . . 10.0 110.83 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.85 169.39 2.83 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.74 1.638 . . . . 10.0 113.92 -168.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 159.3 178.88 33.7 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.907 1.242 . . . . 10.0 112.056 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -68.98 168.3 14.04 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 122.026 0.917 . . . . 10.0 110.886 164.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.523 ' CD2' HD22 ' A' ' 31' ' ' ASN . 12.7 m170 -68.27 164.66 20.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.071 1.749 . . . . 10.0 111.478 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HE2' ' C ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -143.11 -46.66 0.3 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.654 0.613 . . . . 10.0 112.654 -171.048 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.1 m -154.06 -30.75 0.12 Allowed 'General case' 0 N--CA 1.479 0.987 0 O-C-N 121.09 -1.006 . . . . 10.0 110.977 168.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.69 -174.28 25.82 Favored Glycine 0 CA--C 1.541 1.71 0 N-CA-C 110.402 -1.079 . . . . 10.0 110.402 150.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -65.92 173.83 6.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.639 2.226 . . . . 10.0 110.267 168.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.532 HD21 ' CD2' ' A' ' 33' ' ' HIS . 13.7 p30 -74.01 0.71 12.8 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.391 1.477 . . . . 10.0 112.87 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.47 28.23 15.16 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.429 2.292 . . . . 10.0 114.77 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.532 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -53.74 157.42 2.31 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.826 1.25 . . . . 10.0 112.613 168.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.23 8.69 3.62 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 127.821 2.629 . . . . 10.0 118.787 149.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.436 ' CD2' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -73.17 -173.86 1.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.603 1.702 . . . . 10.0 114.001 -177.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 60.58 48.39 7.47 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.813 1.645 . . . . 10.0 110.367 -152.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 146.06 -17.38 1.74 Allowed Glycine 0 CA--C 1.545 1.927 0 N-CA-C 117.921 1.928 . . . . 10.0 117.921 176.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.436 ' NH1' ' CD2' ' A' ' 35' ' ' LEU . 16.2 ttp180 -63.58 3.92 0.3 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.708 2.484 . . . . 10.0 117.708 -165.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.279 0.0 OUTLIER 70.58 -0.76 2.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.944 2.497 . . . . 10.0 116.615 -170.185 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.293 13.8 t 52.47 -43.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 129.585 3.154 . . . . 10.0 116.217 -165.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.85 76.23 0.01 OUTLIER Glycine 0 CA--C 1.534 1.221 0 C-N-CA 126.468 1.985 . . . . 10.0 112.828 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -168.1 123.0 0.97 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.327 2.251 . . . . 10.0 111.203 -175.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.92 119.02 0.97 Allowed Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.149 1.379 . . . . 10.0 109.394 169.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 69.5 2.9 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.678 2.919 . . . . 10.0 112.134 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.12 75.59 1.25 Allowed Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.215 1.864 . . . . 10.0 112.962 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -146.56 179.88 7.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.442 1.497 . . . . 10.0 109.658 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 94.2 m -154.79 88.76 1.2 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.737 1.215 . . . . 10.0 108.838 171.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.485 1.514 . . . . 10.0 110.87 169.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 52.4 p -75.19 71.46 2.22 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.149 0.98 . . . . 10.0 110.909 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -55.97 -12.87 1.57 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.215 2.206 . . . . 10.0 116.112 -161.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.33 -26.65 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.452 -1.405 . . . . 10.0 113.141 165.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.476 ' HB2' HD12 ' A' ' 75' ' ' ILE . 17.2 p30 -78.14 -67.86 0.69 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.345 1.979 . . . . 10.0 116.345 159.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.51 -39.27 48.15 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.134 1.333 . . . . 10.0 113.248 -174.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -19.99 65.5 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.445 1.498 . . . . 10.0 114.043 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -66.92 -27.34 67.41 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.928 1.695 . . . . 10.0 111.648 168.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.79 12.13 64.1 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 115.619 1.007 . . . . 10.0 115.619 168.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -53.82 -10.17 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 127.655 2.382 . . . . 10.0 115.882 -174.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 88.8 m 57.38 128.61 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 130.122 3.369 . . . . 10.0 115.511 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -75.76 145.8 40.51 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.18 -0.918 . . . . 10.0 112.973 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 175.33 175.18 0.23 Allowed 'General case' 0 CA--C 1.538 0.487 1 C-N-CA 133.33 4.652 . . . . 10.0 106.035 -179.421 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.79 -30.39 22.83 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.517 1.302 . . . . 10.0 114.517 177.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -75.43 5.65 5.54 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.978 2.214 . . . . 10.0 116.978 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.2 p -160.53 -31.07 0.06 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.968 1.307 . . . . 10.0 111.706 -171.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 -19.67 58.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.5 1.046 . . . . 10.0 112.468 171.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -60.82 3.19 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 162.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -53.4 -45.71 69.41 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 127.741 2.416 . . . . 10.0 110.124 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CE1' HD11 ' A' ' 75' ' ' ILE . 70.6 t80 -73.47 -46.91 45.34 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 117.867 -1.063 . . . . 10.0 113.371 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.24 -39.78 95.6 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.969 1.713 . . . . 10.0 111.699 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -65.16 -32.5 74.22 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.578 1.081 . . . . 10.0 113.411 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.15 77.05 1.82 Allowed Pre-proline 0 CA--C 1.558 1.271 0 CA-C-N 119.858 1.208 . . . . 10.0 111.802 -175.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.14 -54.81 0.35 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.112 1.875 . . . . 10.0 112.905 -160.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -64.58 -23.03 67.13 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.322 1.849 . . . . 10.0 113.596 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -77.21 -47.44 20.22 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.622 1.169 . . . . 10.0 111.758 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.89 -45.0 94.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 178.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 52' ' ' ASN . 6.1 pt -136.65 145.94 53.32 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.838 0.855 . . . . 10.0 111.697 176.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.76 161.04 40.04 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 122.994 2.463 . . . . 10.0 113.266 -168.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.22 -25.16 0.26 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 126.328 1.918 . . . . 10.0 116.84 171.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.8 m -36.68 115.63 0.38 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.18 2.592 . . . . 10.0 114.674 -165.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -86.44 6.66 29.26 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.088 1.514 . . . . 10.0 115.088 177.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.4 ttt -60.4 92.13 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.625 -0.672 . . . . 10.0 109.416 158.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.2 tt -68.06 -17.84 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 122.7 1.238 . . . . 10.0 113.656 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -75.28 78.45 2.38 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.366 2.266 . . . . 10.0 110.728 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.08 59.79 0.18 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.786 1.634 . . . . 10.0 113.193 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.9 -166.12 29.8 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.456 1.503 . . . . 10.0 113.955 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -142.07 155.64 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.951 1.301 . . . . 10.0 109.439 -171.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -67.37 -78.4 0.06 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.158 1.783 . . . . 10.0 113.793 -153.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -76.43 106.75 8.24 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.51 -12.09 2.45 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 116.556 2.058 . . . . 10.0 116.556 -167.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 m -57.68 -40.28 79.05 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.269 1.428 . . . . 10.0 112.798 161.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.88 -35.27 66.32 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.458 1.503 . . . . 10.0 110.863 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.84 2.58 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.59 1.956 . . . . 10.0 114.312 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.491 ' HA ' ' H ' ' A' ' 95' ' ' ILE . 7.3 pt-20 -157.18 -5.4 0.1 Allowed 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.043 1.337 . . . . 10.0 113.5 -174.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -57.21 -47.67 80.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 140.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.58 -49.47 72.64 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.71 1.604 . . . . 10.0 114.577 170.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.491 ' H ' ' HA ' ' A' ' 92' ' ' GLU . 11.2 mm -60.0 -46.43 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.54 83.83 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.184 0.994 . . . . 10.0 112.423 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -58.7 7.39 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.657 1.183 . . . . 10.0 112.083 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.88 -31.6 72.63 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.038 0.836 . . . . 10.0 112.799 -174.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -64.29 -17.98 64.15 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.483 0.92 . . . . 10.0 113.483 173.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -92.32 -56.17 3.14 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.568 -1.206 . . . . 10.0 110.273 163.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.12 32.96 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.58 1.696 . . . . 10.0 115.58 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.4 t -68.21 -19.01 64.73 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.692 1.368 . . . . 10.0 114.692 168.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.34 -0.78 0.23 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 116.467 2.025 . . . . 10.0 116.467 -166.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 126.8 2.04 . . . . 10.0 110.611 -171.28 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.409 ' CGA' HH22 ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 110.429 -1.068 . . . . 10.0 110.429 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.96 148.01 44.67 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.327 1.851 . . . . 10.0 112.676 -171.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.03 -38.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 121.625 -0.672 . . . . 10.0 111.581 172.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 4.7 mp0 -57.16 -44.67 83.68 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.1 1.148 . . . . 10.0 114.1 173.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -63.84 -33.47 75.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 117.86 0.3 . . . . 10.0 110.639 173.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.03 -41.68 31.64 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.302 1.429 . . . . 10.0 111.178 -172.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' A' ' 4' ' ' GLU . 30.7 pttt -69.21 -36.17 76.97 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 118.297 1.049 . . . . 10.0 111.96 174.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.81 -55.91 28.35 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.637 0.775 . . . . 10.0 111.351 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.537 HG13 HD11 ' A' ' 85' ' ' ILE . 9.8 tp -64.56 -33.24 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.576 0.626 . . . . 10.0 112.564 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 39.1 t80 -57.65 -52.5 65.17 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 119.126 0.876 . . . . 10.0 110.459 169.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -62.21 -13.3 9.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -97.29 -36.16 10.49 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.494 1.518 . . . . 10.0 112.785 -175.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -137.01 3.63 2.68 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 116.373 1.99 . . . . 10.0 116.373 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.401 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.7 m -122.77 -43.02 2.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.208 1.403 . . . . 10.0 111.839 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.5 4.9 2.06 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.667 1.358 . . . . 10.0 114.667 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -38.46 14.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.511 1.524 . . . . 10.0 111.932 172.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 m -88.61 -38.04 15.15 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.487 2.315 . . . . 10.0 113.751 168.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.425 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.6 m-70 -114.66 -172.59 2.14 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 129.137 2.975 . . . . 10.0 111.917 -175.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.4 m -166.41 153.1 9.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.68 1.992 . . . . 10.0 108.163 157.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.8 p -156.65 -35.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 113.562 0.949 . . . . 10.0 113.562 169.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -60.33 -4.13 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 130.675 3.59 . . . . 10.0 115.96 -168.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -151.17 7.35 0.52 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.68 2.792 . . . . 10.0 111.662 -170.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.3 160.36 3.08 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.536 1.541 . . . . 10.0 111.943 -161.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 165.31 168.74 27.95 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.83 -1.394 . . . . 10.0 114.125 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -77.13 -152.78 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.935 2.094 . . . . 10.0 111.627 170.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -151.11 136.89 18.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.803 2.041 . . . . 10.0 109.198 -173.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 0.7 OUTLIER -143.57 -25.86 0.57 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.691 0.796 . . . . 10.0 112.91 -160.744 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.5 m -152.86 -21.27 0.16 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.788 -1.195 . . . . 10.0 111.852 170.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.425 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -128.18 172.57 19.16 Favored Glycine 0 CA--C 1.544 1.887 0 C-N-CA 124.488 1.042 . . . . 10.0 110.964 150.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.21 166.02 22.51 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 124.392 3.395 . . . . 10.0 112.416 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.98 137.67 57.88 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.07 -1.019 . . . . 10.0 109.196 159.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.83 60.98 2.38 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.349 1.431 . . . . 10.0 111.981 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.18 87.65 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 130.263 3.425 . . . . 10.0 113.568 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.36 43.04 65.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.953 1.74 . . . . 10.0 114.663 169.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.634 ' CD2' HMA3 ' A' ' 105' ' ' HEC . 6.4 mp -72.4 149.6 44.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 117.849 0.825 . . . . 10.0 110.577 173.239 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 75.52 76.41 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.017 2.527 . . . . 10.0 111.609 -161.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.54 29.97 0.23 Allowed Glycine 0 CA--C 1.536 1.361 0 N-CA-C 117.353 1.701 . . . . 10.0 117.353 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.477 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 13.0 ptt85 -152.53 -84.17 0.08 Allowed 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 120.748 2.274 . . . . 10.0 115.787 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 16.7 pttp -168.28 -176.38 2.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.697 2.799 . . . . 10.0 109.943 -177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -67.15 -132.72 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.718 2.007 . . . . 10.0 111.873 162.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -18.17 115.96 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 1 C-N-CA 130.708 4.004 . . . . 10.0 117.809 -178.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -152.23 3.52 0.37 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 117.971 2.582 . . . . 10.0 117.971 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 155.0 88.64 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 121.299 1.863 . . . . 10.0 111.874 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.29 74.04 3.16 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.243 2.628 . . . . 10.0 109.637 170.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.48 -73.22 1.63 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.03 1.3 . . . . 10.0 111.624 -170.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 t80 43.6 -143.73 0.12 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.632 1.173 . . . . 10.0 110.102 -164.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.8 m -164.5 108.76 0.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.809 2.044 . . . . 10.0 108.096 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -152.8 176.53 11.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.151 1.38 . . . . 10.0 112.211 -172.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.4 p -80.35 109.78 15.17 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.021 0.915 . . . . 10.0 111.99 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -55.05 -22.41 15.79 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.743 0.817 . . . . 10.0 112.821 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -48.72 -43.04 36.98 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.495 1.118 . . . . 10.0 113.445 170.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.416 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -76.58 -38.81 54.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.751 1.221 . . . . 10.0 112.673 172.663 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 52' ' ' ASN . 6.8 mmpt? -74.93 -52.11 12.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.819 0.847 . . . . 10.0 110.827 -172.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.97 -21.04 66.39 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.62 1.568 . . . . 10.0 113.466 173.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -28.84 62.85 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.426 1.012 . . . . 10.0 112.815 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.04 4.46 72.48 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 123.878 0.751 . . . . 10.0 114.907 168.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 pp -61.26 178.23 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 10.0 111.313 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.0 m -148.77 108.81 4.08 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 123.256 1.503 . . . . 10.0 111.195 -163.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.496 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 16.5 m95 -54.48 116.37 2.62 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.708 2.003 . . . . 10.0 109.24 169.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 -44.98 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.187 1.395 . . . . 10.0 113.07 -168.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -170.03 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.683 1.993 . . . . 10.0 107.32 162.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -47.34 -54.85 10.04 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.353 2.661 . . . . 10.0 112.399 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -52.72 60.83 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 128.371 2.668 . . . . 10.0 111.962 -176.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.06 -28.34 61.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.919 0.888 . . . . 10.0 112.302 -177.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.87 -55.08 33.47 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.562 0.745 . . . . 10.0 109.957 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.54 -43.79 98.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.458 1.103 . . . . 10.0 110.433 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.8 t80 -66.41 -46.58 76.09 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.038 0.935 . . . . 10.0 112.053 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 -37.25 83.23 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.77 1.623 . . . . 10.0 112.698 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.64 -36.76 84.89 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.036 -0.983 . . . . 10.0 113.063 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -163.45 106.19 0.97 Allowed Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 119.685 1.129 . . . . 10.0 111.873 160.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.43 -48.76 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.481 2.121 . . . . 10.0 110.685 -171.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -37.9 77.2 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.177 1.391 . . . . 10.0 112.475 179.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -61.6 -54.54 41.57 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.69 1.196 . . . . 10.0 110.63 168.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -64.43 -45.25 88.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.918 1.081 . . . . 10.0 113.918 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 pt -136.0 95.45 13.62 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 123.992 0.917 . . . . 10.0 110.548 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.01 76.69 2.05 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 125.035 3.824 . . . . 10.0 113.84 -163.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.51 -25.5 0.03 OUTLIER Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.222 1.868 . . . . 10.0 112.061 165.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.3 t -40.02 116.91 0.7 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.864 2.066 . . . . 10.0 113.975 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -83.18 16.0 2.62 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.148 0.795 . . . . 10.0 113.148 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.8 ttt -67.16 79.1 0.14 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.845 1.307 . . . . 10.0 111.344 171.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tp -72.99 87.07 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 125.307 1.443 . . . . 10.0 111.714 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -161.49 -51.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.01 -0.995 . . . . 10.0 113.547 175.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.02 92.96 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.137 2.175 . . . . 10.0 115.871 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.22 -178.86 36.05 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.638 1.113 . . . . 10.0 111.436 -169.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.587 HD12 HBB1 ' A' ' 105' ' ' HEC . 13.5 tt -155.55 82.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.201 1.0 . . . . 10.0 110.35 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 59.78 -54.18 0.07 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 128.065 2.546 . . . . 10.0 116.157 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.24 166.53 25.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.021 2.529 . . . . 10.0 110.417 -174.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -53.95 -46.23 71.51 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.189 0.995 . . . . 10.0 113.083 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.1 m -68.34 -34.32 75.88 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.669 -0.644 . . . . 10.0 111.896 -175.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -76.86 -10.5 59.41 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.372 1.069 . . . . 10.0 113.445 171.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -35.22 35.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.098 -1.626 . . . . 10.0 114.436 155.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -62.33 -57.14 12.45 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.153 -0.967 . . . . 10.0 111.333 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 58.5 p30 -54.92 -40.65 70.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.725 1.21 . . . . 10.0 112.804 -175.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 85' ' ' ILE . 14.9 tp -60.94 -53.88 51.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.912 2.485 . . . . 10.0 112.996 177.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.02 -44.92 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.185 0.994 . . . . 10.0 108.872 174.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.02 -49.97 75.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.661 0.385 . . . . 10.0 111.369 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.8 -61.75 2.1 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.267 1.427 . . . . 10.0 112.068 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.2 mt -59.65 -38.12 80.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.66 1.118 . . . . 10.0 111.815 -176.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -64.76 -24.45 67.56 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.277 1.031 . . . . 10.0 113.596 176.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.512 ' HA ' ' HE2' ' A' ' 100' ' ' LYS . 8.5 mmpt? -87.37 -40.33 14.52 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.847 -1.073 . . . . 10.0 112.239 166.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.68 -22.76 65.6 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.379 1.251 . . . . 10.0 114.379 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t -85.73 9.35 16.67 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 169.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -151.58 21.09 0.72 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.454 2.302 . . . . 10.0 111.88 -166.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.817 1.647 . . . . 10.0 111.217 -174.904 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.634 HMA3 ' CD2' ' A' ' 35' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -81.99 -177.81 6.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.282 0.633 . . . . 10.0 109.493 160.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.03 -34.14 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 120.672 -1.268 . . . . 10.0 111.041 145.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -71.55 -38.75 70.96 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 127.937 2.495 . . . . 10.0 113.557 -157.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 3.6 mmpt? -63.6 -31.33 72.47 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 173.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.19 -54.04 9.65 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 127.254 2.359 . . . . 10.0 110.29 -173.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -44.91 85.4 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.098 0.777 . . . . 10.0 113.098 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -26.97 60.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.93 1.455 . . . . 10.0 114.93 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -81.39 -32.49 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.669 1.577 . . . . 10.0 111.67 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.41 -51.33 69.87 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 121.677 -0.639 . . . . 10.0 110.219 170.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.99 -12.01 8.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -83.54 -61.3 1.87 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.232 1.013 . . . . 10.0 110.855 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -102.64 -38.25 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.599 1.16 . . . . 10.0 112.457 -170.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.7 m -83.08 -55.17 4.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.128 1.371 . . . . 10.0 111.902 -172.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.61 -15.74 42.03 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -172.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -59.6 -54.52 45.47 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 129.378 3.071 . . . . 10.0 111.898 167.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.8 m -87.5 -21.22 25.61 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.117 1.525 . . . . 10.0 115.117 169.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -134.7 57.64 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.966 1.706 . . . . 10.0 111.991 -167.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.83 120.29 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.72 -1.238 . . . . 10.0 110.827 -174.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.48 -58.39 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 127.068 2.147 . . . . 10.0 108.792 -177.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 -62.31 9.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.187 2.995 . . . . 10.0 114.376 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -151.86 17.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.16 1.784 . . . . 10.0 112.75 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.33 142.86 9.1 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.847 1.689 . . . . 10.0 111.444 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.78 129.51 9.18 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.702 1.144 . . . . 10.0 113.15 -172.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -164.19 -179.21 5.99 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 127.415 2.286 . . . . 10.0 109.258 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.412 ' CD2' HD22 ' A' ' 31' ' ' ASN . 6.9 m170 -149.52 122.17 8.61 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.95 1.3 . . . . 10.0 107.545 -168.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.01 109.58 0.9 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.23 1.412 . . . . 10.0 109.713 -173.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 m 57.09 -43.35 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.902 2.081 . . . . 10.0 114.144 -161.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.5 166.81 12.44 Favored Glycine 0 CA--C 1.543 1.826 0 CA-C-N 120.191 1.36 . . . . 10.0 113.7 169.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.79 173.58 14.18 Favored 'Trans proline' 0 CA--C 1.541 0.836 1 C-N-CA 125.326 4.017 . . . . 10.0 111.097 167.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.511 HD21 ' CD2' ' A' ' 33' ' ' HIS . 5.9 p30 -77.58 -172.48 2.58 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.222 -0.924 . . . . 10.0 108.745 158.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.1 mt -139.37 51.98 1.75 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 122.798 1.285 . . . . 10.0 111.866 -175.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.511 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -54.22 134.78 44.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.866 2.866 . . . . 10.0 113.165 162.13 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 54.0 8.38 1.01 Allowed Glycine 0 CA--C 1.54 1.616 0 N-CA-C 118.883 2.313 . . . . 10.0 118.883 160.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -51.55 167.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.784 1.634 . . . . 10.0 111.027 170.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 61.99 36.31 15.64 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.765 1.226 . . . . 10.0 112.554 -169.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 168.4 -42.82 0.23 Allowed Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.565 1.555 . . . . 10.0 110.894 -175.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 41.6 mtp85 -80.81 159.65 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 122.442 1.115 . . . . 10.0 112.067 167.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -70.71 173.91 6.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.682 1.993 . . . . 10.0 110.998 168.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -67.74 168.76 10.77 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.327 1.851 . . . . 10.0 111.334 157.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 53' ' ' LYS . . . 94.08 14.69 51.01 Favored Glycine 0 N--CA 1.471 0.998 0 N-CA-C 117.657 1.823 . . . . 10.0 117.657 160.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.86 -40.52 11.14 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.952 2.101 . . . . 10.0 115.269 -158.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.63 111.17 2.81 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.13 1.372 . . . . 10.0 114.228 -164.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 131.01 18.79 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.417 2.078 . . . . 10.0 112.129 -174.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.01 1.8 69.49 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.91 0.724 . . . . 10.0 114.91 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -73.2 179.27 3.96 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 118.433 1.117 . . . . 10.0 111.052 167.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 98.7 m -154.18 89.02 1.26 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 119.517 -1.99 . . . . 10.0 109.631 176.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.35 173.61 10.8 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 128.508 2.723 . . . . 10.0 112.277 172.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.8 p -71.21 143.87 50.31 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.423 -0.798 . . . . 10.0 110.508 163.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -76.23 65.14 2.13 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.648 -1.283 . . . . 10.0 111.154 166.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.96 -59.35 0.6 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.203 1.001 . . . . 10.0 110.474 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -54.88 -70.1 0.11 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.919 1.687 . . . . 10.0 111.231 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HB3' ' HA2' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -63.68 -13.13 40.07 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 130.566 3.547 . . . . 10.0 115.309 171.067 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.29 -56.27 7.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.178 -0.951 . . . . 10.0 111.485 160.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -56.3 -27.95 57.2 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.385 1.874 . . . . 10.0 115.448 -170.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.97 7.09 61.54 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.967 1.147 . . . . 10.0 115.967 168.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -56.93 5.96 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 129.463 3.105 . . . . 10.0 117.155 -171.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.6 m 50.59 87.8 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.39 2.676 . . . . 10.0 113.627 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.499 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 3.5 m95 -54.45 125.17 18.48 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.601 2.361 . . . . 10.0 114.987 -171.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -164.66 179.17 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.386 2.674 . . . . 10.0 109.343 -173.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -58.01 -39.3 77.96 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.173 -0.954 . . . . 10.0 112.784 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.89 10.28 0.22 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.444 1.898 . . . . 10.0 115.251 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.2 p -158.21 -33.13 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.757 1.223 . . . . 10.0 111.464 -166.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.13 -29.35 63.98 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 120.469 1.486 . . . . 10.0 112.508 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 73.9 mtm -71.52 -40.1 70.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.251 0.932 . . . . 10.0 111.844 175.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -50.48 72.02 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 167.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.5 -44.73 86.12 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 113.361 0.874 . . . . 10.0 113.361 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.548 ' HB2' HH11 ' A' ' 91' ' ' ARG . 2.7 mm? -73.38 -22.59 60.23 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 121.047 1.749 . . . . 10.0 113.715 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -85.75 -23.85 27.13 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.26 1.208 . . . . 10.0 114.26 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.64 65.56 1.97 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.942 1.297 . . . . 10.0 111.445 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -62.05 -51.55 3.61 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.993 2.462 . . . . 10.0 113.267 -164.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -70.72 -20.8 62.62 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.165 1.786 . . . . 10.0 112.734 -173.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -76.28 -54.39 6.85 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.376 1.47 . . . . 10.0 111.148 163.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -56.87 -45.8 82.24 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.191 0.597 . . . . 10.0 112.335 -175.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.2 pt -133.44 111.91 12.83 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.632 1.173 . . . . 10.0 109.663 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.91 161.11 40.91 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.789 1.66 . . . . 10.0 110.306 175.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.36 5.8 82.58 Favored Glycine 0 CA--C 1.536 1.373 0 CA-C-O 118.648 -1.085 . . . . 10.0 114.769 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m -93.79 122.22 36.04 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.526 1.663 . . . . 10.0 110.769 165.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.26 -10.19 55.05 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.598 1.332 . . . . 10.0 114.598 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttt -21.65 97.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.855 2.862 . . . . 10.0 114.853 -172.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.8 mp -80.09 69.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 125.652 1.581 . . . . 10.0 109.93 -172.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -164.23 -37.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.069 1.747 . . . . 10.0 111.662 170.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.31 -8.7 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 120.8 3.63 . . . . 10.0 120.8 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.09 118.94 0.75 Allowed Glycine 0 CA--C 1.53 1.003 0 CA-C-N 121.185 1.812 . . . . 10.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.0 tt -66.78 -1.71 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 115.332 1.604 . . . . 10.0 115.332 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.0 tttt 70.34 178.01 0.26 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.09 1.756 . . . . 10.0 111.302 -177.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.42 ' HE2' ' OE2' ' A' ' 90' ' ' GLU . 17.8 mtmm 34.26 -105.3 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 127.435 2.294 . . . . 10.0 112.931 -172.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -178.86 -42.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 CA-C-N 120.449 1.477 . . . . 10.0 114.036 171.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.1 m -54.06 -34.63 60.58 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.604 1.162 . . . . 10.0 111.785 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.42 ' OE2' ' HE2' ' A' ' 87' ' ' LYS . 50.2 mp0 -51.75 -41.5 61.64 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.205 2.202 . . . . 10.0 111.891 172.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.548 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -69.17 -49.0 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.357 1.463 . . . . 10.0 110.829 -178.496 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -68.39 -32.97 73.41 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.533 1.06 . . . . 10.0 112.503 175.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -44.67 96.7 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.37 -0.832 . . . . 10.0 111.439 169.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp -58.53 -35.79 72.85 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.023 1.119 . . . . 10.0 114.023 171.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.51 -53.14 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.88 0.764 . . . . 10.0 109.17 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -49.42 77.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.871 0.468 . . . . 10.0 111.72 178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.22 -50.88 68.28 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.148 1.379 . . . . 10.0 112.662 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.78 -32.56 65.69 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.861 1.664 . . . . 10.0 112.31 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.07 -38.83 80.36 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.132 0.878 . . . . 10.0 111.618 170.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -65.41 -70.91 0.21 Allowed 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 117.282 -1.342 . . . . 10.0 111.635 163.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.41 -17.57 13.54 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 116.146 1.906 . . . . 10.0 116.146 -166.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 28.4 p -76.23 -0.45 22.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.437 1.495 . . . . 10.0 114.131 167.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.52 -19.89 0.17 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.925 2.49 . . . . 10.0 114.944 -178.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.227 2.611 . . . . 10.0 110.901 -171.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.499 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.77 0 CA-C-O 119.03 -0.872 . . . . 10.0 111.696 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -129.98 147.33 51.72 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.524 0.935 . . . . 10.0 113.524 -150.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.1 -53.77 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.324 1.45 . . . . 10.0 111.615 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.02 -50.2 74.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.893 1.677 . . . . 10.0 113.496 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.96 -37.08 42.3 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 124.099 0.96 . . . . 10.0 112.082 167.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.28 -52.93 8.1 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.619 -1.392 . . . . 10.0 109.619 -174.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -58.09 -47.12 84.18 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 118.974 1.387 . . . . 10.0 112.31 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -27.0 65.26 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 tp -90.65 -28.82 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.58 1.082 . . . . 10.0 112.551 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.48 -53.02 62.41 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.597 0.759 . . . . 10.0 109.771 166.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.43 -10.63 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -84.99 -57.68 3.0 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.723 1.209 . . . . 10.0 110.895 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -130.41 13.22 5.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.268 1.581 . . . . 10.0 115.268 -168.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.1 m -120.57 -45.29 2.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.906 1.283 . . . . 10.0 111.548 170.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.42 -28.79 70.04 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 114.201 1.186 . . . . 10.0 114.201 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -4.25 3.22 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.709 1.604 . . . . 10.0 114.282 171.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -143.56 6.69 1.46 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.168 2.187 . . . . 10.0 112.69 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -158.47 102.28 1.72 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.746 1.619 . . . . 10.0 108.903 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 p -52.6 -47.83 66.67 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.087 1.884 . . . . 10.0 116.087 -169.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.411 HG22 ' HB2' ' A' ' 32' ' ' LEU . 5.6 t 34.12 -82.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 130.134 3.374 . . . . 10.0 115.857 170.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.27 2.22 0.89 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.081 2.152 . . . . 10.0 113.272 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -151.16 134.31 15.99 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 128.839 2.856 . . . . 10.0 107.87 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.73 74.08 1.82 Allowed Glycine 0 CA--C 1.531 1.063 0 C-N-CA 123.993 0.806 . . . . 10.0 113.574 -172.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.54 159.54 23.45 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-N 117.747 0.774 . . . . 10.0 114.792 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 61.91 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 129.489 3.115 . . . . 10.0 115.768 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.4 m80 70.33 -63.99 0.38 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.545 2.738 . . . . 10.0 113.022 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 50.23 103.37 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 129.236 3.014 . . . . 10.0 113.497 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m 58.3 -25.63 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 128.46 2.704 . . . . 10.0 117.203 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.68 148.76 20.03 Favored Glycine 0 CA--C 1.538 1.496 0 CA-C-N 120.97 1.713 . . . . 10.0 111.787 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -78.34 61.71 7.92 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.019 3.146 . . . . 10.0 114.801 -160.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 49.11 0.81 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 120.536 3.532 . . . . 10.0 120.536 165.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.411 ' HB2' HG22 ' A' ' 20' ' ' VAL . 1.5 mm? 42.56 60.41 2.4 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.592 1.957 . . . . 10.0 110.798 -171.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.79 168.51 0.28 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.92 -1.036 . . . . 10.0 109.678 157.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -23.27 110.57 0.01 OUTLIER Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.645 1.593 . . . . 10.0 113.519 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.95 -74.59 0.61 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.799 1.24 . . . . 10.0 110.036 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -64.88 84.99 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.506 1.922 . . . . 10.0 111.34 -171.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.71 -4.42 2.45 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.756 1.645 . . . . 10.0 114.696 -172.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -152.74 -172.23 4.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.365 1.466 . . . . 10.0 111.2 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -85.62 -173.71 4.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -175.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -60.78 -151.84 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.004 1.722 . . . . 10.0 111.992 158.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 95.07 -67.33 1.23 Allowed Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.662 -1.899 . . . . 10.0 116.314 167.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -69.25 25.33 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 118.954 2.946 . . . . 10.0 118.954 -152.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.24 113.59 8.41 Favored Pre-proline 0 CA--C 1.554 1.109 0 CA-C-N 121.562 1.983 . . . . 10.0 112.755 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.56 70.78 6.73 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.34 2.693 . . . . 10.0 112.832 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.86 69.76 1.16 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.556 1.074 . . . . 10.0 112.874 172.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -151.74 176.65 11.19 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.064 1.746 . . . . 10.0 109.04 174.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -152.19 115.6 4.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.908 2.083 . . . . 10.0 107.885 -165.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -61.23 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.195 1.398 . . . . 10.0 111.103 -161.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.7 t -162.57 165.73 25.6 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 128.802 2.841 . . . . 10.0 108.874 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.08 -67.5 0.6 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.597 1.159 . . . . 10.0 110.741 157.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.21 -65.07 0.21 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 129.111 2.965 . . . . 10.0 115.333 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.558 HD22 ' CGD' ' A' ' 105' ' ' HEC . 16.1 t30 -51.87 -70.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.07 0.85 . . . . 10.0 111.57 -176.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -74.46 -16.6 60.85 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.853 -165.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.85 -57.66 7.4 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.852 1.261 . . . . 10.0 113.775 157.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -14.93 48.02 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 115.673 1.731 . . . . 10.0 115.673 -163.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.55 11.06 85.66 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 117.915 1.926 . . . . 10.0 117.915 151.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.72 156.16 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 119.819 1.81 . . . . 10.0 113.458 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 m -68.02 108.87 3.24 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.46 1.504 . . . . 10.0 110.716 176.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.414 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 0.0 OUTLIER -76.76 112.38 13.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.82 -0.55 . . . . 10.0 111.555 172.186 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -162.17 -162.57 0.84 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.03 1.332 . . . . 10.0 109.695 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' HD12 ' A' ' 95' ' ' ILE . 40.3 tt0 -41.84 -66.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 131.091 3.756 . . . . 10.0 113.21 -174.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -58.36 -54.62 44.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.247 1.419 . . . . 10.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 78.7 p -67.84 -35.9 79.39 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.039 0.936 . . . . 10.0 112.973 -173.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.18 -27.51 59.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 119.832 1.196 . . . . 10.0 113.504 173.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 69.6 mtm -65.91 -52.13 52.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 119.446 1.021 . . . . 10.0 109.406 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.9 -44.38 91.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.136 0.493 . . . . 10.0 110.477 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -63.89 -55.72 20.63 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -75.22 -10.78 59.78 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 121.066 1.757 . . . . 10.0 113.348 -177.729 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -85.37 -25.42 27.08 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.798 1.181 . . . . 10.0 113.978 167.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -162.33 98.37 1.14 Allowed Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.618 1.099 . . . . 10.0 112.974 157.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.35 -47.68 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.765 1.643 . . . . 10.0 112.042 -167.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -64.89 -32.01 73.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.456 1.502 . . . . 10.0 113.027 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -75.78 -39.13 57.53 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-O 118.108 -0.949 . . . . 10.0 112.728 168.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -68.8 -40.18 79.72 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.517 0.932 . . . . 10.0 113.517 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.02 135.25 25.53 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.803 0.841 . . . . 10.0 110.998 174.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -80.18 50.54 3.57 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.088 3.192 . . . . 10.0 114.544 -157.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.48 61.77 0.01 OUTLIER Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.422 -0.799 . . . . 10.0 114.637 172.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -80.1 -30.16 39.13 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.463 1.283 . . . . 10.0 114.463 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 -22.28 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 117.001 2.223 . . . . 10.0 117.001 -166.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.9 ttt -34.76 100.52 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 129.071 2.948 . . . . 10.0 113.803 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 28.5 mt -76.41 71.74 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 125.879 1.672 . . . . 10.0 109.644 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -163.51 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.254 1.022 . . . . 10.0 113.236 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.78 -15.13 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 120.26 3.43 . . . . 10.0 120.26 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.67 158.52 28.69 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-N 121.695 2.043 . . . . 10.0 113.498 172.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.468 HG23 ' H ' ' A' ' 86' ' ' LYS . 16.3 tt -78.96 -79.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.111 1.523 . . . . 10.0 115.111 -169.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.468 ' H ' HG23 ' A' ' 85' ' ' ILE . 20.6 mtpt -156.9 -52.76 0.08 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.024 1.73 . . . . 10.0 111.635 -169.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -162.99 161.41 25.53 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 129.627 3.171 . . . . 10.0 107.306 174.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -57.26 -46.66 82.84 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.998 0.74 . . . . 10.0 112.998 -168.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . 0.266 83.5 m -64.56 -26.61 68.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.368 1.248 . . . . 10.0 114.368 -176.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.77 -33.84 76.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.357 1.435 . . . . 10.0 111.621 169.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.472 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.29 -45.11 77.54 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.73 1.612 . . . . 10.0 110.121 170.039 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -63.58 -35.56 80.91 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.99 1.316 . . . . 10.0 112.363 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -63.73 -48.97 74.9 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.822 1.649 . . . . 10.0 111.243 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.42 -35.41 62.88 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 61' ' ' GLU . 20.8 mm -59.37 -57.19 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.34 95.91 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.81 0.444 . . . . 10.0 111.946 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -53.53 -63.23 1.21 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.7 1.2 . . . . 10.0 111.522 170.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.24 -27.93 69.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.605 1.093 . . . . 10.0 113.426 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -59.54 -16.76 27.03 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.693 1.133 . . . . 10.0 113.511 170.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.41 33.57 3.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.801 2.04 . . . . 10.0 113.235 165.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.23 24.58 2.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.586 1.155 . . . . 10.0 111.398 171.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -127.68 2.25 6.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.573 1.549 . . . . 10.0 113.242 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -159.64 -59.0 0.06 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.344 1.857 . . . . 10.0 109.649 -154.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 C--O 1.256 1.426 0 CA-C-O 117.004 -1.474 . . . . 10.0 109.446 134.09 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.558 ' CGD' HD22 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.029 0 CA-C-O 117.478 -1.734 . . . . 10.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -131.01 168.15 17.85 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 -166.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.58 -65.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.23 2.612 . . . . 10.0 110.596 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.0 -37.59 74.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.404 1.482 . . . . 10.0 113.243 174.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 5.7 mmpt? -64.84 -16.4 63.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.659 -0.686 . . . . 10.0 112.315 171.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.06 -50.58 1.23 Allowed Glycine 0 N--CA 1.468 0.81 0 C-N-CA 125.974 1.749 . . . . 10.0 112.793 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -60.03 -29.62 68.62 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.629 1.215 . . . . 10.0 113.651 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 5' ' ' LYS . 15.8 pttp -64.22 -32.18 73.66 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.995 0.918 . . . . 10.0 112.532 174.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.82 -47.93 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.603 0.761 . . . . 10.0 109.244 168.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -57.54 -53.56 56.82 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.958 0.345 . . . . 10.0 111.46 -174.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.51 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 73.4 t -63.27 -15.42 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 112.706 0.632 . . . . 10.0 112.706 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -95.88 -63.74 1.12 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.051 2.141 . . . . 10.0 111.055 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -87.67 -17.9 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 -171.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -116.22 -52.63 2.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.148 0.979 . . . . 10.0 111.117 -169.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -74.57 3.71 7.27 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.564 0.95 . . . . 10.0 113.564 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.19 -67.22 0.27 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.439 1.896 . . . . 10.0 108.777 153.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.9 m -82.2 -35.36 28.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.137 1.375 . . . . 10.0 113.906 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.78 -163.0 0.96 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.861 2.465 . . . . 10.0 112.38 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' N ' ' A' ' 20' ' ' VAL . 8.3 t -138.15 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.477 1.111 . . . . 10.0 113.215 169.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' N ' HG23 ' A' ' 19' ' ' THR . 0.4 OUTLIER 40.97 -25.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.346 1 C-N-CA 132.86 4.464 . . . . 10.0 118.295 -161.994 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -140.55 -61.33 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.275 2.23 . . . . 10.0 109.742 -169.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -78.32 88.52 4.35 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.035 0.754 . . . . 10.0 113.035 177.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.28 -0.07 63.57 Favored Glycine 0 CA--C 1.537 1.42 0 N-CA-C 118.627 2.211 . . . . 10.0 118.627 150.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.57 -0.5 81.08 Favored Glycine 0 CA--C 1.536 1.387 0 CA-C-N 120.573 2.186 . . . . 10.0 117.241 166.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.79 155.63 38.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.03 1.332 . . . . 10.0 113.439 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -153.18 127.77 9.38 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.192 0.997 . . . . 10.0 110.056 165.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -144.44 -73.14 0.26 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.507 1.123 . . . . 10.0 110.914 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m -84.83 -16.9 39.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.368 0.667 . . . . 10.0 111.716 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.56 163.22 28.99 Favored Glycine 0 CA--C 1.544 1.859 0 C-N-CA 124.984 1.278 . . . . 10.0 111.662 164.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.36 175.22 2.81 Favored 'Trans proline' 0 C--N 1.353 0.794 1 C-N-CA 125.653 4.236 . . . . 10.0 113.901 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -86.9 0.39 55.09 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.598 1.333 . . . . 10.0 114.598 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 mp 58.27 -31.63 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.105 3.362 . . . . 10.0 115.714 -174.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.09 68.13 0.16 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.549 3.14 . . . . 10.0 113.251 176.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.45 -51.74 2.21 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 126.75 2.119 . . . . 10.0 113.867 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 tp 66.86 -58.12 0.4 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.222 2.609 . . . . 10.0 115.252 173.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.16 115.77 6.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.392 1.077 . . . . 10.0 109.588 -170.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 -8.04 71.59 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 127.076 2.274 . . . . 10.0 114.217 -174.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -87.79 -83.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.082 1.353 . . . . 10.0 114.469 -168.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.65 175.42 1.09 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.341 2.656 . . . . 10.0 111.991 161.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.1 t -82.24 166.31 19.68 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.997 2.119 . . . . 10.0 111.371 163.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.12 -14.64 2.16 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 126.116 1.817 . . . . 10.0 116.789 159.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.72 -5.48 5.88 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 129.042 2.937 . . . . 10.0 115.333 -173.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -46.78 128.54 8.56 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 126.009 1.724 . . . . 10.0 111.851 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.62 106.4 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 123.233 2.622 . . . . 10.0 111.153 -172.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.53 -44.38 1.43 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.21 1.386 . . . . 10.0 113.724 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.43 134.48 56.49 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 122.467 1.127 . . . . 10.0 110.287 -173.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.4 m -150.73 86.36 1.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 123.607 1.67 . . . . 10.0 106.823 -156.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.48 142.8 30.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 131.621 3.968 . . . . 10.0 108.305 173.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.6 t 45.36 -138.31 0.49 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.74 0.816 . . . . 10.0 111.734 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -161.24 -65.69 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.032 1.733 . . . . 10.0 110.433 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.6 -54.69 43.01 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.085 1.354 . . . . 10.0 112.607 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -56.84 -45.86 82.09 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 119.676 1.126 . . . . 10.0 112.561 175.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mmmt -53.81 -49.94 67.24 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.386 1.074 . . . . 10.0 111.722 173.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -66.03 -38.41 88.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.842 1.257 . . . . 10.0 113.219 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -161.07 81.88 0.63 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.438 1.895 . . . . 10.0 110.726 -166.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -118.24 165.58 12.79 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.369 1.462 . . . . 10.0 111.289 164.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -68.11 169.34 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.929 1.691 . . . . 10.0 114.807 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.7 m -72.22 110.19 6.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.296 1.439 . . . . 10.0 111.06 167.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -61.66 140.83 58.12 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.425 1.09 . . . . 10.0 111.388 161.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -178.31 -33.03 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 125.731 1.612 . . . . 10.0 114.998 -169.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 166.46 -61.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.696 2.798 . . . . 10.0 112.306 158.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -41.49 85.31 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.84 1.256 . . . . 10.0 112.091 -177.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -54.71 -38.86 67.58 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.596 1.159 . . . . 10.0 112.579 168.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.2 mp -75.35 -28.64 59.66 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 119.881 1.219 . . . . 10.0 113.579 172.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 38.3 mtt -61.53 -53.61 54.11 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.987 1.267 . . . . 10.0 108.589 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.14 -37.81 88.6 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.699 0.285 . . . . 10.0 110.977 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.04 -45.54 81.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.198 -0.906 . . . . 10.0 113.183 175.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -37.88 89.05 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 120.931 1.696 . . . . 10.0 111.633 176.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -70.2 -24.65 63.15 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.726 1.38 . . . . 10.0 114.726 174.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.8 75.71 2.3 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 119.855 1.207 . . . . 10.0 114.01 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -70.88 -45.71 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.973 1.782 . . . . 10.0 112.224 -168.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -68.84 21.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.82 2.848 . . . . 10.0 114.658 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -161.47 -30.75 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.843 1.657 . . . . 10.0 112.786 -167.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.774 1.028 . . . . 10.0 113.774 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.11 157.11 79.11 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 125.419 1.488 . . . . 10.0 110.257 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.11 117.92 5.26 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.604 2.203 . . . . 10.0 110.603 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 85.64 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.802 1.191 . . . . 10.0 113.612 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -127.28 150.61 49.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.053 1.341 . . . . 10.0 110.53 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -142.0 26.6 1.85 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.763 1.625 . . . . 10.0 113.118 -171.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.3 ttt -55.8 103.97 0.12 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.84 0.856 . . . . 10.0 110.554 159.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.73 79.98 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.578 1.151 . . . . 10.0 109.467 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -161.91 -63.29 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.153 0.581 . . . . 10.0 111.983 174.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.48 -2.63 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 120.495 3.517 . . . . 10.0 120.495 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -145.6 86.47 0.17 Allowed Glycine 0 CA--C 1.529 0.937 0 CA-C-N 120.9 1.682 . . . . 10.0 112.262 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.8 tt -64.24 -57.76 10.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 114.12 1.155 . . . . 10.0 114.12 -170.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm 163.4 -168.75 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 131.667 3.987 . . . . 10.0 109.095 -174.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -53.12 -61.78 2.07 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 128.335 2.654 . . . . 10.0 115.582 -167.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.5 -40.61 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.518 1.527 . . . . 10.0 114.456 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -50.82 60.31 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.397 1.479 . . . . 10.0 111.656 -173.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -53.9 -49.06 69.43 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.389 0.675 . . . . 10.0 110.994 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -33.34 75.24 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.517 1.127 . . . . 10.0 112.788 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -76.68 -33.88 58.23 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 120.394 1.452 . . . . 10.0 114.428 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -69.91 -46.5 65.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.606 1.094 . . . . 10.0 112.069 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.675 HD21 HMB1 ' A' ' 105' ' ' HEC . 12.7 tp -59.58 -39.99 85.91 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.75 1.22 . . . . 10.0 113.265 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mm -65.0 -44.01 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.289 1.036 . . . . 10.0 110.479 173.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.73 -41.2 97.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.299 0.64 . . . . 10.0 111.75 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -56.72 -59.01 5.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.203 1.001 . . . . 10.0 112.418 170.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.8 -27.68 66.08 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.931 1.086 . . . . 10.0 113.931 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -58.89 -28.19 65.92 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.654 1.182 . . . . 10.0 112.637 167.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -81.94 -51.92 7.59 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.931 1.293 . . . . 10.0 111.549 167.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.45 -12.52 15.07 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 116.39 1.996 . . . . 10.0 116.39 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.3 t -72.3 -0.8 13.18 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.723 -1.235 . . . . 10.0 114.312 164.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -151.12 -22.32 0.21 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.94 1.696 . . . . 10.0 113.519 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 127.652 2.381 . . . . 10.0 109.965 172.148 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.675 HMB1 HD21 ' A' ' 94' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.822 0 CA-C-O 119.263 -0.743 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -127.78 136.55 51.64 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.623 0.725 . . . . 10.0 112.583 -150.096 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.49 -58.86 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.141 1.777 . . . . 10.0 110.989 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -60.25 -48.58 81.11 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.031 1.333 . . . . 10.0 113.153 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -53.33 -35.01 59.73 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.497 0.719 . . . . 10.0 111.721 170.02 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.31 -53.55 7.56 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.934 1.254 . . . . 10.0 110.38 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 97' ' ' TYR . 1.2 ptpt -58.75 -44.73 90.62 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.346 1.573 . . . . 10.0 112.679 177.154 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -39.7 79.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 118.07 -0.967 . . . . 10.0 112.898 -178.535 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -73.47 -33.16 39.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.929 1.241 . . . . 10.0 111.955 174.786 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -56.78 -50.56 71.95 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.284 -0.885 . . . . 10.0 110.077 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.487 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 55.2 t -60.15 -14.29 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 177.255 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -94.22 -56.62 2.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.267 1.427 . . . . 10.0 111.503 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -108.11 1.66 22.45 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.15 1.537 . . . . 10.0 115.15 -172.287 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.0 m -123.8 -49.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.126 1.37 . . . . 10.0 112.455 -179.773 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.487 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -69.68 2.93 2.81 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.921 1.082 . . . . 10.0 113.921 178.592 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -59.03 6.1 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.477 -0.764 . . . . 10.0 109.359 158.215 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.4 m -87.58 -28.06 22.16 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.608 1.336 . . . . 10.0 114.608 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -108.35 -168.95 1.43 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.795 2.038 . . . . 10.0 111.558 -176.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.285 6.5 t -137.33 -75.17 0.41 Allowed 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 117.471 -1.252 . . . . 10.0 113.33 165.188 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 6.7 p 45.58 -56.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 130.394 3.478 . . . . 10.0 116.587 -170.553 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -67.93 -10.14 50.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.245 1.818 . . . . 10.0 113.309 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -152.71 148.68 27.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.391 1.877 . . . . 10.0 110.356 -171.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.0 76.6 1.59 Allowed Glycine 0 CA--C 1.527 0.808 0 C-N-CA 125.486 1.517 . . . . 10.0 112.905 -176.359 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.77 -139.87 8.9 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.674 1.13 . . . . 10.0 111.267 169.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 64.51 0.24 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.352 1.061 . . . . 10.0 109.729 169.62 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 59.11 178.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.836 1.654 . . . . 10.0 110.891 -170.359 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -150.82 -110.17 0.06 Allowed 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.97 -1.081 . . . . 10.0 109.454 156.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.0 m -72.18 -27.74 62.77 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.266 1.826 . . . . 10.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.67 176.91 16.57 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 126.047 1.784 . . . . 10.0 111.471 166.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.89 177.13 8.07 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.952 3.101 . . . . 10.0 112.266 177.246 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.53 10.48 27.71 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.941 2.096 . . . . 10.0 114.743 -175.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 mp 57.6 -16.59 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 128.809 2.844 . . . . 10.0 116.029 -176.557 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.94 68.99 0.15 Allowed 'General case' 0 C--O 1.24 0.591 0 C-N-CA 129.546 3.138 . . . . 10.0 115.768 156.738 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 67.02 2.37 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 125.503 1.525 . . . . 10.0 111.11 -176.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.01 171.29 2.28 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 117.993 0.896 . . . . 10.0 112.304 -176.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 76.37 130.09 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 127.642 2.377 . . . . 10.0 114.424 171.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.44 -39.82 1.5 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.004 1.764 . . . . 10.0 113.822 -179.207 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -169.93 0.68 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.777 1.631 . . . . 10.0 113.929 174.089 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.2 mtmm -77.43 -164.43 0.48 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.793 1.637 . . . . 10.0 113.036 -174.817 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -107.3 -99.03 0.36 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 117.586 -1.197 . . . . 10.0 109.981 168.451 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 7.54 -103.94 0.01 OUTLIER Glycine 0 N--CA 1.477 1.389 0 C-N-CA 130.144 3.735 . . . . 10.0 117.743 -177.797 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.9 mm-40 46.42 -14.27 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.087 1 C-N-CA 133.179 4.592 . . . . 10.0 121.695 161.208 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 109.98 2.85 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 121.377 1.899 . . . . 10.0 114.04 -174.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.26 62.59 8.49 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 124.037 3.158 . . . . 10.0 113.593 -167.263 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.45 50.97 0.08 OUTLIER Glycine 0 N--CA 1.473 1.11 0 C-N-CA 124.924 1.25 . . . . 10.0 113.299 175.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -145.92 -177.86 5.81 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.197 2.199 . . . . 10.0 108.078 -176.026 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.7 m -154.49 135.53 13.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 119.715 -1.866 . . . . 10.0 109.105 176.782 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -138.64 173.83 11.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.09 1.356 . . . . 10.0 112.061 -166.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.8 p -69.63 160.49 31.47 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.185 1.394 . . . . 10.0 112.557 172.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -64.8 -178.19 0.4 Allowed 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 114.916 -1.038 . . . . 10.0 111.041 161.44 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.02 -72.0 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.914 2.485 . . . . 10.0 114.02 -173.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -62.36 -64.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.153 0.978 . . . . 10.0 112.273 -169.09 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.406 ' HE3' HBD2 ' A' ' 105' ' ' HEC . 0.0 OUTLIER -77.71 -39.64 43.95 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.531 -1.355 . . . . 10.0 113.869 175.308 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -65.63 -60.74 2.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.881 0.764 . . . . 10.0 112.741 178.34 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 56' ' ' GLY . 0.2 OUTLIER -77.37 -48.56 16.98 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.646 0.778 . . . . 10.0 112.766 -176.843 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 55' ' ' LYS . . . 71.11 176.3 23.03 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.123 1.344 . . . . 10.0 115.481 -177.82 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -168.46 2.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 127.568 2.347 . . . . 10.0 112.099 -165.325 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . 0.266 2.4 m 53.83 113.64 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.022 2.529 . . . . 10.0 114.979 -174.273 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.52 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 38.3 m95 -64.5 156.22 30.35 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.524 -1.216 . . . . 10.0 110.26 163.146 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -174.43 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.697 1.599 . . . . 10.0 112.104 -175.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 165.69 -64.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 130.484 3.514 . . . . 10.0 110.012 173.753 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -46.11 -56.54 5.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.357 1.863 . . . . 10.0 112.769 -179.764 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 75.7 p -61.41 -36.01 79.12 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.679 1.592 . . . . 10.0 112.163 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.466 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.32 -32.37 60.91 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.137 0.975 . . . . 10.0 113.051 173.918 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.9 mtm -63.62 -47.64 80.57 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 118.091 -0.957 . . . . 10.0 109.504 173.343 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -66.0 -43.01 88.99 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.554 0.616 . . . . 10.0 111.14 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -63.06 -49.8 73.11 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -177.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -43.11 92.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.779 1.172 . . . . 10.0 110.58 -178.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -74.11 -20.93 60.09 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.712 1.375 . . . . 10.0 114.712 -177.524 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.32 72.12 2.58 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 118.912 0.778 . . . . 10.0 111.355 178.212 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' HG21 ' A' ' 78' ' ' THR . 12.4 Cg_endo -62.91 -61.49 0.14 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.846 3.031 . . . . 10.0 115.44 -165.317 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -68.93 -26.06 64.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.035 0.934 . . . . 10.0 111.694 -178.127 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.38 90.95 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.861 1.264 . . . . 10.0 110.909 166.585 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -76.21 -53.9 7.58 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.266 -0.896 . . . . 10.0 113.299 178.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.56 119.51 15.18 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.952 1.301 . . . . 10.0 109.37 171.167 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.35 -30.71 44.53 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.864 2.376 . . . . 10.0 113.515 -168.112 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -74.92 70.62 1.75 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.177 0.894 . . . . 10.0 111.625 172.334 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.477 HG21 ' HB2' ' A' ' 71' ' ' PRO . 2.6 m -138.84 152.41 47.82 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.997 0.919 . . . . 10.0 111.43 172.607 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -141.41 12.87 2.16 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.237 1.815 . . . . 10.0 113.327 -178.848 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.2 ttt -55.03 93.02 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.255 1.822 . . . . 10.0 111.967 165.581 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.9 mm -71.79 76.65 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 124.812 1.245 . . . . 10.0 110.086 176.264 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -162.18 -74.09 0.05 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.959 0.726 . . . . 10.0 112.959 176.33 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.73 -67.94 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.443 2.697 . . . . 10.0 116.46 -169.29 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.9 82.1 0.12 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 125.984 1.754 . . . . 10.0 112.653 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 tt -61.43 -43.83 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 123.905 0.882 . . . . 10.0 112.293 -165.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.253 10.8 mtpt 161.45 -78.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 130.938 3.695 . . . . 10.0 110.061 146.026 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -77.0 -83.59 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt 173.69 -43.76 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 128.12 2.568 . . . . 10.0 110.706 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.7 m -50.53 -40.59 52.1 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.334 1.853 . . . . 10.0 112.168 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -59.89 -39.78 86.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.446 0.698 . . . . 10.0 111.072 177.237 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.466 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -62.67 -51.2 68.19 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.104 1.362 . . . . 10.0 109.881 -179.354 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.07 -26.68 59.54 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -66.66 -43.06 85.56 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.605 1.093 . . . . 10.0 110.916 168.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.35 -35.71 72.36 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.439 1.274 . . . . 10.0 114.439 174.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.36 -55.88 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 172.462 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -43.9 88.74 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.251 0.621 . . . . 10.0 111.946 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 101' ' ' ALA . 3.0 t80 -52.84 -63.41 1.15 Allowed 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.776 1.23 . . . . 10.0 111.739 170.565 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 89.6 mt -64.23 -30.1 71.17 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.719 1.145 . . . . 10.0 112.334 -174.335 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -57.69 -32.93 67.85 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.241 1.017 . . . . 10.0 112.497 171.627 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.5 mmtt -80.62 -53.37 6.6 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 125.065 1.346 . . . . 10.0 111.98 165.214 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.482 ' HB2' ' CE1' ' A' ' 97' ' ' TYR . . . -55.79 -24.3 34.96 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.319 1.97 . . . . 10.0 116.319 -167.143 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.5 t -74.14 2.11 9.7 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.126 0.971 . . . . 10.0 113.599 171.329 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -152.99 -18.55 0.15 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 127.941 2.496 . . . . 10.0 114.981 -179.578 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.064 2.146 . . . . 10.0 113.316 -171.996 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.52 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 109.266 -1.533 . . . . 10.0 109.266 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.569 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 1.8 m-20 -114.87 -113.56 0.34 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.463 1.505 . . . . 10.0 111.357 -165.397 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -161.51 -59.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 128.39 2.676 . . . . 10.0 107.499 -179.137 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.06 -48.83 75.31 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.398 1.079 . . . . 10.0 112.405 176.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -62.18 -14.89 42.28 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.965 1.098 . . . . 10.0 113.965 172.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.45 -55.8 2.52 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 125.292 1.425 . . . . 10.0 110.032 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 pttt -61.19 -37.48 83.11 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.144 0.972 . . . . 10.0 113.197 -176.463 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -13.95 60.91 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.216 1.191 . . . . 10.0 114.216 176.578 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.1 mm -103.22 -34.61 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.593 1.157 . . . . 10.0 111.222 169.711 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.6 t80 -54.67 -53.15 58.61 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.611 0.641 . . . . 10.0 110.793 172.065 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -66.61 -8.04 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.513 -0.742 . . . . 10.0 112.637 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.84 -50.04 5.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.501 1.92 . . . . 10.0 111.224 -177.078 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -122.82 -1.23 8.94 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -174.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 22.0 m -117.48 -46.2 2.69 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.562 1.145 . . . . 10.0 111.358 -177.355 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.08 -10.75 6.68 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.063 0.764 . . . . 10.0 113.063 168.296 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -19.02 40.31 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.716 1.606 . . . . 10.0 113.042 166.148 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -143.4 -26.59 0.57 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.537 1.935 . . . . 10.0 115.074 -177.77 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -110.18 -172.84 2.12 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 128.056 2.542 . . . . 10.0 110.727 179.102 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.7 p -131.16 -82.68 0.52 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.863 1.06 . . . . 10.0 113.863 169.592 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.294 9.9 p 50.96 -45.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 131.507 3.923 . . . . 10.0 116.502 -169.752 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -72.81 -4.33 30.97 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.096 1.358 . . . . 10.0 112.165 170.079 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -151.66 173.41 14.71 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.588 1.955 . . . . 10.0 110.031 -166.631 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.4 64.77 1.71 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.206 1.384 . . . . 10.0 116.512 -163.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.51 0.62 8.48 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.267 2.067 . . . . 10.0 118.267 156.518 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -61.75 73.11 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 128.504 2.722 . . . . 10.0 112.642 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.26 77.18 0.25 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.489 1.138 . . . . 10.0 110.872 167.862 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -73.71 -22.99 59.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.317 2.247 . . . . 10.0 113.538 178.653 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.6 m -161.2 -28.63 0.05 Allowed 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.548 -0.72 . . . . 10.0 112.904 -174.616 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -123.12 160.43 17.63 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.828 1.204 . . . . 10.0 111.116 166.122 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -66.56 6.45 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.742 1 C-N-CA 126.905 5.07 . . . . 10.0 117.378 -162.416 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 61.77 159.74 0.06 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.968 2.107 . . . . 10.0 112.171 -147.394 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.76 78.35 9.58 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.334 -1.358 . . . . 10.0 107.334 165.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 83.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.467 1.107 . . . . 10.0 110.928 176.748 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.87 -67.66 0.07 OUTLIER Glycine 0 CA--C 1.529 0.936 0 C-N-CA 128.047 2.737 . . . . 10.0 113.158 -178.7 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.57 -179.84 0.16 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.503 2.721 . . . . 10.0 111.43 -169.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 67.79 82.58 0.17 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.448 1.899 . . . . 10.0 113.504 -174.02 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.68 -33.69 4.02 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.234 1.873 . . . . 10.0 112.602 169.041 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -77.62 -168.16 1.12 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.046 1.338 . . . . 10.0 111.576 165.537 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.63 158.5 44.23 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.826 1.25 . . . . 10.0 110.044 -167.87 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -62.25 158.99 15.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 115.357 1.614 . . . . 10.0 115.357 -169.45 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.65 7.9 38.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.436 1.735 . . . . 10.0 117.436 169.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -100.65 12.35 37.6 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -161.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.42 146.08 89.91 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.031 0.932 . . . . 10.0 113.513 -178.559 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.63 58.92 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.727 2.951 . . . . 10.0 113.709 178.92 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 106.96 0.78 36.12 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 125.459 1.504 . . . . 10.0 116.134 168.019 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.63 132.97 51.23 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.969 1.385 . . . . 10.0 113.266 179.071 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -71.78 84.93 0.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.977 1.711 . . . . 10.0 112.219 175.782 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.404 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -82.77 175.19 10.31 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.105 1.362 . . . . 10.0 111.478 163.872 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -69.94 158.61 35.28 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.249 -0.907 . . . . 10.0 110.482 171.179 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 17.4 t0 -75.62 -9.32 58.49 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -178.479 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.16 -77.95 0.21 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.001 0.92 . . . . 10.0 113.162 -170.763 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -68.11 -23.81 64.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.828 1.418 . . . . 10.0 114.828 -163.084 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HG2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -64.62 -34.94 79.45 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.672 1.124 . . . . 10.0 113.3 169.501 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.82 -69.11 0.35 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.852 0.751 . . . . 10.0 110.693 162.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -76.92 60.81 1.84 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 10.0 112.414 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -85.09 -162.47 35.65 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.539 1.542 . . . . 10.0 114.637 -177.554 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.0 pt -169.06 146.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 127.79 2.436 . . . . 10.0 107.945 -166.468 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.0 m -72.59 124.4 25.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.058 1.343 . . . . 10.0 110.302 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -75.41 130.99 39.87 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 123.178 0.591 . . . . 10.0 111.277 175.651 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -164.47 161.49 21.4 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.447 2.299 . . . . 10.0 108.942 -168.151 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.99 46.82 0.06 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.58 1.952 . . . . 10.0 113.374 176.42 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -162.35 -62.14 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 129.25 3.02 . . . . 10.0 107.543 -171.171 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 44.5 p -65.99 -29.62 70.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 117.681 -1.152 . . . . 10.0 113.05 -177.071 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.27 -26.65 60.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.679 1.127 . . . . 10.0 112.908 169.577 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.2 mtt -65.54 -53.47 41.69 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.824 1.193 . . . . 10.0 108.421 172.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -67.33 -38.94 85.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.68 -0.236 . . . . 10.0 111.006 -176.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -60.72 -63.31 1.34 Allowed 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 119.044 -0.503 . . . . 10.0 111.453 173.071 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -32.83 74.56 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 120.155 1.343 . . . . 10.0 111.615 -169.941 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.48 -17.64 55.98 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.922 1.453 . . . . 10.0 114.922 175.501 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.09 56.26 0.81 Allowed Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.329 1.452 . . . . 10.0 112.189 -169.574 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.8 -50.92 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.661 2.241 . . . . 10.0 112.772 -159.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -64.27 -24.77 67.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.462 1.905 . . . . 10.0 112.865 -177.252 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -75.34 -54.13 7.58 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.948 1.299 . . . . 10.0 110.546 167.066 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -69.54 -30.71 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 -170.024 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 pt -140.43 118.13 8.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.465 1.106 . . . . 10.0 109.963 163.021 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.8 151.69 74.17 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.501 2.134 . . . . 10.0 111.484 -176.157 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.37 5.49 67.33 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 118.726 -1.041 . . . . 10.0 115.223 179.524 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 t -75.25 -3.56 33.93 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 116.258 1.947 . . . . 10.0 116.258 -170.302 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.2 tptp 59.28 -18.88 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 119.316 3.08 . . . . 10.0 119.316 159.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 19.3 ttt -46.32 114.6 0.83 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.904 2.481 . . . . 10.0 112.058 178.0 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.6 mp -82.43 52.72 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.715 1.206 . . . . 10.0 110.427 -176.973 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -164.06 150.98 11.7 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.02 1.728 . . . . 10.0 108.939 169.806 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.28 139.36 5.82 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.424 1.49 . . . . 10.0 108.69 177.461 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.19 87.88 0.49 Allowed Glycine 0 CA--C 1.529 0.911 0 CA-C-N 118.084 0.402 . . . . 10.0 112.837 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.3 tt -68.51 12.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.977 1.843 . . . . 10.0 115.977 -166.42 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 59.4 -0.26 0.18 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.881 2.549 . . . . 10.0 117.881 173.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -160.27 104.12 1.46 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.879 2.072 . . . . 10.0 109.199 -168.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -67.67 -13.77 62.37 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.338 1.607 . . . . 10.0 115.338 -177.319 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -62.76 -63.22 1.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.005 0.821 . . . . 10.0 109.323 163.432 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -50.87 -34.71 29.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.447 1.899 . . . . 10.0 112.814 176.695 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.2 tpm_? -51.18 -50.08 59.69 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 174.049 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -75.52 -43.47 48.79 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.952 1.701 . . . . 10.0 110.641 175.237 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.569 ' CG ' ' H ' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -57.3 -50.13 73.89 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.078 1.751 . . . . 10.0 112.124 -174.226 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -65.79 -38.68 89.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.4 0.546 . . . . 10.0 112.232 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.8 mt -61.38 -48.82 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.414 0.686 . . . . 10.0 109.492 176.578 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.67 93.85 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.748 1.219 . . . . 10.0 112.868 176.22 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.422 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -50.16 -53.29 28.72 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.023 1.329 . . . . 10.0 111.394 169.651 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 35.8 mt -67.54 -31.58 71.78 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.381 -0.824 . . . . 10.0 112.843 178.534 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -59.61 -26.88 65.82 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.323 1.231 . . . . 10.0 114.323 167.485 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.79 -54.36 9.07 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.011 0.823 . . . . 10.0 109.998 162.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.19 -25.48 33.02 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.512 1.671 . . . . 10.0 115.512 -175.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.25 5.6 11.89 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.052 1.341 . . . . 10.0 114.161 172.584 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -150.21 -15.63 0.25 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.564 1.946 . . . . 10.0 113.72 -170.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 C--O 1.258 1.515 0 C-N-CA 126.873 2.069 . . . . 10.0 110.221 -161.488 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.286 0 CA-C-O 119.59 -0.561 . . . . 10.0 111.973 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -131.79 122.3 25.57 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.299 1.04 . . . . 10.0 111.134 -157.068 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -52.82 -55.95 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.012 1.725 . . . . 10.0 111.71 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.8 -44.16 90.71 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 113.646 0.98 . . . . 10.0 113.646 -178.196 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.1 -36.12 72.42 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.156 0.582 . . . . 10.0 110.195 172.851 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.75 -45.54 16.87 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 124.68 1.133 . . . . 10.0 110.972 -175.029 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -74.95 -29.12 60.85 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -60.86 -53.48 56.78 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.43 1.013 . . . . 10.0 111.051 168.587 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.9 tp -64.23 -32.28 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 118.787 0.721 . . . . 10.0 112.001 177.34 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.494 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.7 t80 -59.37 -56.93 15.77 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 118.912 0.778 . . . . 10.0 111.311 170.874 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.32 -9.06 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 O-C-N 121.633 -0.667 . . . . 10.0 112.713 -178.353 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -63.67 1.25 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.743 1.217 . . . . 10.0 110.501 173.828 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -113.61 -2.78 13.72 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.774 1.768 . . . . 10.0 115.774 -167.795 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.3 m -103.44 -42.96 5.54 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 124.234 1.014 . . . . 10.0 111.23 171.051 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.01 -9.57 4.54 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.233 1.198 . . . . 10.0 114.233 173.191 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.73 -16.43 63.76 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.226 1.41 . . . . 10.0 112.979 167.855 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -143.54 -33.9 0.42 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.828 1.651 . . . . 10.0 113.928 -177.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.403 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 93.2 m-70 -100.76 -178.16 3.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.372 2.269 . . . . 10.0 110.621 173.443 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.4 t -175.74 117.25 0.15 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.38 1.072 . . . . 10.0 110.771 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.4 p -143.74 -63.64 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.217 1.407 . . . . 10.0 112.761 -173.899 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -66.45 -32.21 73.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 120.87 1.668 . . . . 10.0 110.507 170.153 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -68.05 120.74 14.78 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.745 1.218 . . . . 10.0 109.065 156.027 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.81 65.16 1.84 Allowed Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.91 0.767 . . . . 10.0 112.914 174.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.91 -146.24 13.04 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.226 1.393 . . . . 10.0 114.376 -175.695 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 pttp -161.68 69.77 0.32 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.683 1.593 . . . . 10.0 112.061 -167.647 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p80 34.28 80.72 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.337 2.655 . . . . 10.0 115.08 163.753 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -68.53 -47.94 65.62 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.011 1.725 . . . . 10.0 112.944 -168.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -152.51 -23.49 0.17 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.424 1.49 . . . . 10.0 111.923 -166.879 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.403 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -119.71 -178.94 16.51 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 126.3 1.905 . . . . 10.0 108.934 155.462 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 92.9 Cg_endo -72.84 -176.45 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 CA-C-N 120.03 1.915 . . . . 10.0 111.251 176.377 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -64.42 -35.92 82.48 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 179.342 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp 67.53 68.48 0.37 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.832 2.853 . . . . 10.0 111.006 -150.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.88 73.71 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.47 1.908 . . . . 10.0 112.619 161.501 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.58 -67.48 0.41 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 127.402 2.429 . . . . 10.0 114.706 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 54.1 -163.79 0.11 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.116 2.166 . . . . 10.0 113.084 -169.87 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 67.86 10.14 7.59 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.105 2.562 . . . . 10.0 114.743 -176.644 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -160.17 13.06 0.18 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.787 1.66 . . . . 10.0 114.16 -179.475 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.51 169.29 24.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.826 1.25 . . . . 10.0 111.943 -177.194 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -65.04 163.28 15.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.85 1.66 . . . . 10.0 112.564 179.245 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.4 p -69.82 164.58 23.34 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.414 0.686 . . . . 10.0 110.957 170.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.46 -112.76 3.78 Favored Glycine 0 N--CA 1.47 0.938 0 CA-C-O 118.193 -1.337 . . . . 10.0 115.68 169.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 38.37 2.41 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 1 C-N-CA 132.02 4.128 . . . . 10.0 121.104 178.756 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 30' ' ' PRO . . . -44.89 104.25 0.38 Allowed Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 127.653 2.381 . . . . 10.0 114.814 -178.612 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.91 50.73 3.57 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 123.778 2.985 . . . . 10.0 113.217 -172.303 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.69 49.75 0.1 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.573 1.558 . . . . 10.0 113.853 176.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 48' ' ' TYR . 2.9 t80 -148.97 118.0 6.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.257 1.023 . . . . 10.0 110.868 176.327 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.3 m -72.34 118.04 14.74 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.857 1.663 . . . . 10.0 111.088 176.35 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.701 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -127.89 177.19 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.371 1.868 . . . . 10.0 112.337 -175.639 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.6 p -77.65 142.66 38.73 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.282 -0.886 . . . . 10.0 111.788 168.845 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -65.11 -171.96 0.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.207 2.203 . . . . 10.0 112.769 163.92 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 59.1 -67.13 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.445 2.698 . . . . 10.0 112.093 -166.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -47.77 -31.73 5.17 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 130.209 3.404 . . . . 10.0 113.769 -179.301 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.701 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 27.4 mtmm -158.7 4.3 0.1 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 129.029 2.931 . . . . 10.0 112.467 -162.378 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.71 -62.48 1.37 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.672 0.789 . . . . 10.0 111.098 138.026 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -19.74 58.58 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.304 1.442 . . . . 10.0 114.812 -163.785 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.28 28.05 46.13 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-O 117.471 -1.738 . . . . 10.0 116.358 161.559 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 pp -54.98 20.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 130.346 3.458 . . . . 10.0 119.801 -167.418 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.2 m 55.64 99.27 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 128.865 2.866 . . . . 10.0 115.033 177.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -70.47 124.46 24.25 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.606 -0.684 . . . . 10.0 111.238 167.169 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt -163.86 170.18 17.18 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 129.565 3.146 . . . . 10.0 107.82 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -56.13 -33.61 65.33 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -60.86 -65.28 0.72 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.454 1.102 . . . . 10.0 111.887 171.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.0 p -62.69 -39.51 94.2 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.637 1.175 . . . . 10.0 111.981 -175.822 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.67 -16.99 59.39 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 174.954 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 29.0 mtm -68.27 -60.42 2.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.629 1.104 . . . . 10.0 108.741 160.566 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.63 -43.85 72.64 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.872 0.733 . . . . 10.0 111.006 -175.772 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -64.8 -54.97 22.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.151 -0.928 . . . . 10.0 113.07 178.038 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -26.09 65.37 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.741 1.61 . . . . 10.0 113.644 -178.688 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.46 -36.45 79.01 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.933 1.242 . . . . 10.0 112.614 171.153 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -161.58 96.01 1.3 Allowed Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.721 1.146 . . . . 10.0 112.594 169.638 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.67 -44.11 0.76 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.416 2.077 . . . . 10.0 111.098 -167.237 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -71.66 -24.08 61.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.092 1.757 . . . . 10.0 114.342 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -75.99 -40.11 54.47 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.886 1.221 . . . . 10.0 112.469 162.418 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -68.27 -41.06 81.62 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.258 0.836 . . . . 10.0 113.258 -176.482 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.47 156.96 69.29 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.244 1.018 . . . . 10.0 111.967 169.29 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.02 164.95 24.56 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.158 2.572 . . . . 10.0 114.833 -172.626 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.52 -77.43 0.09 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 127.157 2.313 . . . . 10.0 112.082 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m 58.8 -40.65 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 130.297 3.439 . . . . 10.0 118.954 164.266 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt 55.49 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 117.85 2.537 . . . . 10.0 117.85 174.629 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -64.59 79.52 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.054 1.742 . . . . 10.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tp -70.56 79.51 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.905 1.682 . . . . 10.0 111.395 178.096 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -161.12 -60.6 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 117.873 -1.061 . . . . 10.0 113.561 -176.25 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.14 91.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.931 2.197 . . . . 10.0 116.931 172.069 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.58 105.53 1.94 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 124.354 0.978 . . . . 10.0 111.285 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.5 tt -62.92 -56.3 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.439 0.903 . . . . 10.0 113.439 -165.435 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -162.34 -66.27 0.05 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.537 1.935 . . . . 10.0 111.111 174.049 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.9 mtmt -161.67 169.85 20.81 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.693 2.397 . . . . 10.0 107.886 -162.788 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -75.38 -11.35 60.03 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 -167.138 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.6 m -75.6 -56.17 4.95 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.942 1.247 . . . . 10.0 109.418 169.578 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -53.83 -36.79 62.93 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.819 2.047 . . . . 10.0 111.329 178.378 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -53.73 -46.11 70.74 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 126.833 2.053 . . . . 10.0 114.188 171.222 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -73.14 -45.12 58.55 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.112 0.965 . . . . 10.0 110.587 173.776 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -56.77 -49.23 75.92 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.781 1.232 . . . . 10.0 111.312 -170.264 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.1 -50.28 73.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.602 1.161 . . . . 10.0 112.538 174.365 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.8 mm -58.09 -47.18 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.182 0.993 . . . . 10.0 109.733 177.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.21 -47.32 85.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.585 1.154 . . . . 10.0 111.864 177.736 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -56.14 -56.79 16.61 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 118.661 -0.685 . . . . 10.0 112.081 173.375 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.69 -33.37 74.78 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.237 0.926 . . . . 10.0 112.484 -174.682 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -70.97 -23.58 62.24 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.381 1.252 . . . . 10.0 114.381 174.634 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -73.34 -59.23 2.81 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.687 -1.149 . . . . 10.0 110.825 159.605 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.86 -22.61 38.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 115.671 1.73 . . . . 10.0 115.671 -169.592 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 t -76.63 4.21 9.91 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.342 1.457 . . . . 10.0 114.582 169.92 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -150.37 -32.98 0.18 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.251 2.22 . . . . 10.0 112.925 -170.472 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 . . . . . 0 C--O 1.251 1.135 0 C-N-CA 127.595 2.358 . . . . 10.0 110.149 -156.93 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.988 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -156.67 170.94 21.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.941 1.371 . . . . 10.0 110.367 161.075 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.4 t -70.08 -67.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 126.267 1.827 . . . . 10.0 109.842 172.413 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -37.97 89.37 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.78 1.232 . . . . 10.0 112.509 179.74 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 mttp -73.17 4.56 4.31 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 118.094 -0.955 . . . . 10.0 113.422 168.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.63 -32.44 3.38 Favored Glycine 0 N--CA 1.472 1.036 0 CA-C-N 119.832 1.197 . . . . 10.0 114.505 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -29.72 65.4 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.791 1.796 . . . . 10.0 112.429 169.917 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.475 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.06 -15.73 63.31 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.372 1.619 . . . . 10.0 115.372 179.039 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.475 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 10.9 tp -110.46 -32.16 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.82 1.248 . . . . 10.0 111.252 170.375 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -54.61 -54.92 35.02 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 118.567 0.621 . . . . 10.0 110.088 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.32 -9.84 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.898 0.879 . . . . 10.0 112.673 -178.994 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -99.45 -35.81 9.78 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.26 1.824 . . . . 10.0 112.869 -173.348 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.42 -57.73 2.04 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.3 1.04 . . . . 10.0 111.709 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -56.52 -48.91 76.21 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.343 1.057 . . . . 10.0 112.24 -176.074 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.84 3.2 3.43 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.924 1.453 . . . . 10.0 114.924 174.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.37 -11.69 61.08 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 120.169 1.35 . . . . 10.0 111.854 162.089 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.18 -47.13 0.35 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.402 1.481 . . . . 10.0 112.33 -174.538 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -88.77 -170.71 3.03 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 127.194 2.197 . . . . 10.0 111.751 176.543 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.568 HG23 ' H ' ' A' ' 20' ' ' VAL . 5.1 t -131.52 -76.49 0.52 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.774 1.23 . . . . 10.0 113.666 -178.388 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' H ' HG23 ' A' ' 19' ' ' THR . 31.0 t 59.06 -60.46 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 129.925 3.29 . . . . 10.0 113.87 -174.934 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -128.35 -23.99 3.16 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 128.421 2.688 . . . . 10.0 110.52 -173.019 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -77.36 72.41 3.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.149 1.38 . . . . 10.0 110.681 168.261 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.39 -86.38 0.02 OUTLIER Glycine 0 CA--C 1.534 1.27 0 C-N-CA 127.597 2.522 . . . . 10.0 115.613 169.797 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.1 104.08 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 124.255 0.931 . . . . 10.0 112.244 -178.267 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -164.26 159.71 20.3 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.289 1.836 . . . . 10.0 112.225 178.687 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -157.3 108.96 2.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.066 1.746 . . . . 10.0 107.746 175.69 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -141.58 127.77 19.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.441 2.296 . . . . 10.0 107.747 -169.133 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.498 ' O ' HMD3 ' A' ' 105' ' ' HEC . 32.1 m 56.36 -26.8 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 127.73 2.412 . . . . 10.0 115.74 -169.609 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.02 172.48 17.13 Favored Glycine 0 CA--C 1.544 1.889 0 C-N-CA 127.336 2.398 . . . . 10.0 111.885 160.549 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -75.87 -128.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.692 4.262 . . . . 10.0 110.725 175.596 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -144.76 -173.36 4.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.341 1.857 . . . . 10.0 109.784 -178.825 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.14 65.18 1.4 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 122.445 1.116 . . . . 10.0 109.497 175.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.31 77.06 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.16 2.584 . . . . 10.0 112.483 164.525 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.49 -58.31 0.3 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 128.976 3.179 . . . . 10.0 112.505 -172.387 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.263 0.1 OUTLIER 48.19 -106.54 0.17 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.658 2.383 . . . . 10.0 111.378 -165.516 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.327 9.6 m-85 33.86 39.7 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.171 2.988 . . . . 10.0 117.258 171.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 131.81 -16.08 5.08 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 126.82 2.153 . . . . 10.0 115.801 -175.306 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -64.23 -88.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.448 2.124 . . . . 10.0 113.967 -176.632 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.01 168.53 3.46 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 128.365 2.666 . . . . 10.0 111.641 163.159 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.7 p -67.53 163.26 21.52 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.448 2.299 . . . . 10.0 113.994 -177.755 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.75 9.37 81.21 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 117.979 1.952 . . . . 10.0 117.979 145.433 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -96.53 139.27 32.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.723 1.762 . . . . 10.0 113.199 -174.387 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.8 152.13 11.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.862 2.065 . . . . 10.0 108.741 160.713 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.24 67.97 8.43 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.987 2.458 . . . . 10.0 111.325 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.76 4.26 51.99 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 116.338 1.295 . . . . 10.0 116.338 169.746 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -70.1 175.04 4.79 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 119.173 1.486 . . . . 10.0 111.466 166.734 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -152.71 137.48 17.03 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.849 -1.157 . . . . 10.0 112.101 -174.753 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -156.66 169.42 24.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.591 2.356 . . . . 10.0 111.032 -153.715 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.8 p -64.86 122.95 18.14 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.026 0.83 . . . . 10.0 112.333 -172.032 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -35.55 71.28 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.716 1.376 . . . . 10.0 114.716 -159.495 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.73 -27.89 68.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -179.107 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -58.31 -62.66 1.67 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.082 0.953 . . . . 10.0 111.339 -175.854 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.445 ' H ' ' HD3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -45.79 -54.88 7.3 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.869 1.667 . . . . 10.0 110.189 177.953 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -65.96 -30.62 71.22 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.327 1.851 . . . . 10.0 114.51 -177.022 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -22.4 66.26 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 117.237 -1.363 . . . . 10.0 113.493 -179.135 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.04 -10.95 2.17 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 118.011 1.964 . . . . 10.0 118.011 154.637 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -15.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 128.521 2.728 . . . . 10.0 115.653 -178.28 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.9 m 58.39 128.48 0.01 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 131.201 3.8 . . . . 10.0 113.932 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -69.34 123.15 20.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.182 -0.917 . . . . 10.0 111.058 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.96 176.53 9.31 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 127.247 2.219 . . . . 10.0 109.466 -177.313 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -47.24 -26.87 1.31 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.79 2.836 . . . . 10.0 114.771 178.677 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -74.26 -71.27 0.34 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 10.0 112.519 167.194 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 56.8 p -75.37 -36.03 61.02 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 128.544 2.737 . . . . 10.0 112.074 -158.478 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.68 -21.28 59.49 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.571 1.148 . . . . 10.0 111.504 175.839 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.5 ttm -64.47 -53.95 40.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.153 0.581 . . . . 10.0 109.51 168.487 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -63.22 -46.89 84.89 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.595 0.559 . . . . 10.0 110.681 178.136 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.9 -48.04 72.79 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 113.331 0.863 . . . . 10.0 113.331 -174.314 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -17.93 59.79 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.638 1.563 . . . . 10.0 114.122 175.331 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -72.46 -33.3 66.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.989 1.722 . . . . 10.0 113.696 164.657 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.74 110.5 0.95 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 120.164 1.347 . . . . 10.0 113.713 158.622 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.19 -44.01 0.48 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.753 1.635 . . . . 10.0 112.174 -167.607 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.1 mtmp? -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.74 2.416 . . . . 10.0 113.259 178.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -70.55 -54.6 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.294 1.438 . . . . 10.0 109.368 172.245 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -72.81 -32.15 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.777 1.029 . . . . 10.0 113.777 -166.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 14.6 pt -137.11 143.89 43.85 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.069 0.948 . . . . 10.0 110.656 173.194 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.64 74.47 5.44 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.372 2.714 . . . . 10.0 112.941 -165.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.13 -100.72 0.18 Allowed Glycine 0 CA--C 1.524 0.611 0 C-N-CA 124.43 1.014 . . . . 10.0 111.554 166.35 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.8 m 51.04 93.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.03 2.532 . . . . 10.0 115.737 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -64.55 16.07 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 128.125 2.57 . . . . 10.0 115.271 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.5 ttt -69.76 90.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.302 1.441 . . . . 10.0 111.143 -178.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 81' ' ' ILE . 1.9 mp -66.34 69.58 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.607 1.963 . . . . 10.0 111.591 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -163.73 -42.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.943 1.697 . . . . 10.0 111.806 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.32 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 120.89 3.663 . . . . 10.0 120.89 178.501 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -166.39 147.09 11.61 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 121.427 1.922 . . . . 10.0 111.345 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.269 12.2 tt -71.23 -68.02 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.19 1.552 . . . . 10.0 115.19 -165.221 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.3 tttm -176.85 -51.25 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.156 1.782 . . . . 10.0 112.487 -179.381 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.479 ' HE3' ' HB ' ' A' ' 89' ' ' THR . 28.3 ttpt -164.24 146.87 9.12 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.947 2.099 . . . . 10.0 107.628 -160.491 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -58.84 -32.33 69.32 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 -176.146 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.479 ' HB ' ' HE3' ' A' ' 87' ' ' LYS . 4.9 m -61.67 -34.02 75.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.172 0.804 . . . . 10.0 113.172 174.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -76.3 -37.14 57.89 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.587 0.63 . . . . 10.0 111.73 171.475 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -55.15 -45.47 75.67 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.911 -1.118 . . . . 10.0 111.679 172.828 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -56.1 -53.89 51.58 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.623 1.169 . . . . 10.0 111.673 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -60.21 -34.87 74.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.528 0.731 . . . . 10.0 112.804 -169.079 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.49 -44.72 90.1 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.162 -0.961 . . . . 10.0 112.99 172.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.65 -46.82 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 109.158 -0.682 . . . . 10.0 109.158 177.624 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.76 -55.58 32.37 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.782 0.833 . . . . 10.0 111.903 173.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -50.68 -60.82 2.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.353 1.861 . . . . 10.0 112.505 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.9 -20.21 58.21 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.365 1.246 . . . . 10.0 114.365 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.445 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.6 OUTLIER -67.32 -29.35 68.89 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.166 1.348 . . . . 10.0 112.271 168.324 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -69.76 -39.73 76.53 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 117.674 -1.155 . . . . 10.0 112.24 165.305 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.86 -9.0 2.48 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 116.22 1.933 . . . . 10.0 116.22 -178.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 22.7 p -94.59 7.36 45.95 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.96 1.304 . . . . 10.0 114.016 167.133 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -150.68 -15.42 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.322 1.449 . . . . 10.0 113.495 -163.167 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 C--O 1.255 1.367 0 C-N-CA 130.21 3.404 . . . . 10.0 107.964 179.716 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.498 HMD3 ' O ' ' A' ' 28' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 CA-C-O 119.71 -0.494 . . . . 10.0 112.356 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -86.94 103.13 15.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.221 1.408 . . . . 10.0 111.825 -163.854 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.7 m -60.54 -16.0 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 114.161 1.171 . . . . 10.0 114.161 -175.224 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -69.59 -59.6 2.86 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.873 2.069 . . . . 10.0 111.693 167.762 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -53.75 -27.79 30.69 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.842 0.857 . . . . 10.0 112.254 170.252 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.18 -47.76 12.46 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.699 1.142 . . . . 10.0 111.863 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.89 -39.9 79.51 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.397 1.099 . . . . 10.0 112.231 177.153 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -40.6 81.5 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.739 -1.6 . . . . 10.0 111.504 178.285 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.5 -33.61 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 121.559 1.981 . . . . 10.0 111.062 173.261 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -57.18 -53.78 54.24 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 118.854 0.752 . . . . 10.0 110.425 170.397 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.52 -10.34 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 N-CA-C 113.677 0.992 . . . . 10.0 113.677 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -96.81 -38.28 9.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.66 1.984 . . . . 10.0 111.598 -176.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -125.66 -17.35 5.51 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 115.031 1.493 . . . . 10.0 115.031 -172.292 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.0 m -112.49 -39.88 4.25 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 125.07 1.348 . . . . 10.0 112.235 -172.305 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.07 -17.31 9.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.743 0.645 . . . . 10.0 112.743 170.208 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.36 -29.07 32.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.061 1.744 . . . . 10.0 113.052 166.681 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.7 m -145.34 11.3 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 126.52 1.928 . . . . 10.0 114.983 -177.565 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -149.38 -178.3 6.34 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.106 1.321 . . . . 10.0 111.385 -177.453 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -150.91 172.76 15.16 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.357 -1.464 . . . . 10.0 108.071 151.11 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -166.09 -41.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.623 1.569 . . . . 10.0 111.869 162.365 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.81 82.71 0.11 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.729 0.812 . . . . 10.0 109.181 172.081 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 56.41 -174.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.883 2.073 . . . . 10.0 111.206 -166.897 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.59 29.46 63.98 Favored Glycine 0 CA--C 1.54 1.613 0 N-CA-C 116.956 1.543 . . . . 10.0 116.956 170.373 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.22 127.4 38.93 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 119.15 1.475 . . . . 10.0 112.556 175.975 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -163.32 8.39 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.685 1.735 . . . . 10.0 115.685 -171.171 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 63.74 -70.35 0.07 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.201 3.001 . . . . 10.0 111.742 -177.93 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 43.02 97.57 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 130.485 3.514 . . . . 10.0 114.157 175.019 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.0 m 58.23 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 127.782 2.433 . . . . 10.0 116.123 -169.84 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.09 -176.4 14.4 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 120.168 1.349 . . . . 10.0 113.842 174.888 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.39 -2.59 12.63 Favored 'Trans proline' 0 CA--C 1.536 0.585 1 C-N-CA 125.978 4.452 . . . . 10.0 115.885 -175.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.421 0.1 OUTLIER 43.56 158.0 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.847 2.859 . . . . 10.0 117.336 -154.818 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.38 24.42 1.16 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 119.749 -1.844 . . . . 10.0 113.875 -167.747 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.457 ' CD2' HE21 ' A' ' 42' ' ' GLN . 0.2 OUTLIER -57.28 98.96 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 130.001 3.32 . . . . 10.0 114.436 -166.334 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.53 7.72 61.55 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.468 1.033 . . . . 10.0 114.378 176.557 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.49 178.4 0.42 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.115 1.458 . . . . 10.0 110.569 168.672 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.25 18.0 m-85 63.69 26.2 14.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 10.0 113.939 -159.068 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 176.61 15.11 0.02 OUTLIER Glycine 0 CA--C 1.536 1.39 0 C-N-CA 126.141 1.829 . . . . 10.0 114.716 -175.731 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -153.15 160.26 42.83 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.074 1.437 . . . . 10.0 111.304 -168.537 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.5 pttm -81.05 160.1 24.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.609 1.564 . . . . 10.0 112.762 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 t -58.47 150.07 23.54 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.082 -0.386 . . . . 10.0 110.354 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.24 63.6 0.8 Allowed Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.261 0.934 . . . . 10.0 112.138 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.457 HE21 ' CD2' ' A' ' 33' ' ' HIS . 13.3 pt20 -154.21 -19.49 0.13 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -177.585 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 136.15 96.59 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 119.169 0.895 . . . . 10.0 112.163 -168.993 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.91 72.96 5.0 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.631 2.887 . . . . 10.0 113.074 -168.743 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.01 2.37 52.24 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.77 1.468 . . . . 10.0 116.77 165.171 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.64 155.16 34.22 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 119.178 1.489 . . . . 10.0 111.163 175.433 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 m -71.72 74.87 0.84 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.341 1.456 . . . . 10.0 113.42 -176.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -83.67 172.88 11.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.752 1.621 . . . . 10.0 111.935 166.2 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.9 p -77.3 172.98 12.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 121.254 -0.904 . . . . 10.0 111.526 167.706 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -69.23 -63.28 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.095 -1.003 . . . . 10.0 111.392 169.288 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.8 -39.46 65.49 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.899 1.28 . . . . 10.0 113.92 -160.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -61.86 -38.44 88.25 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.678 0.791 . . . . 10.0 112.942 178.335 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.487 ' HE3' ' HA ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -77.19 -51.28 11.23 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.528 1.931 . . . . 10.0 110.701 173.834 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.36 -30.91 71.79 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.069 2.147 . . . . 10.0 113.32 -174.334 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 mmmm -159.99 16.58 0.14 Allowed 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.135 0.974 . . . . 10.0 113.391 -153.343 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.63 -133.61 0.67 Allowed Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.335 0.969 . . . . 10.0 111.878 163.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -170.23 -178.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.977 1.711 . . . . 10.0 110.521 -157.226 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 m -74.46 119.62 18.9 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.522 1.529 . . . . 10.0 111.194 172.437 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -77.14 62.07 2.16 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.461 1.504 . . . . 10.0 110.991 169.205 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -78.27 0.18 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 131.321 3.848 . . . . 10.0 115.643 -172.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 179.46 -9.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.992 2.917 . . . . 10.0 114.415 -176.307 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -81.82 -64.63 1.14 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.519 1.963 . . . . 10.0 112.857 160.099 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.8 p -54.74 -35.79 64.11 Favored 'General case' 0 N--CA 1.467 0.388 1 C-N-CA 132.078 4.151 . . . . 10.0 114.913 -165.613 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.6 mp -69.99 -24.56 63.33 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 117.606 -1.187 . . . . 10.0 113.103 175.327 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -41.91 68.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 120.55 1.523 . . . . 10.0 109.425 175.741 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -46.61 78.33 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.418 -0.513 . . . . 10.0 110.336 172.415 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -67.64 -43.6 79.93 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.711 1.004 . . . . 10.0 113.711 -174.712 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.35 -34.36 74.47 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.884 1.675 . . . . 10.0 112.572 177.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -76.36 -25.77 55.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.494 0.718 . . . . 10.0 112.694 177.147 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.58 74.63 2.11 Favored Pre-proline 0 CA--C 1.559 1.296 0 N-CA-C 113.275 0.842 . . . . 10.0 113.275 -178.25 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.29 -50.13 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.887 2.391 . . . . 10.0 112.487 -166.678 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -66.85 -22.26 65.99 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.798 1.639 . . . . 10.0 113.689 -178.747 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -75.41 -53.33 8.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.327 1.051 . . . . 10.0 110.274 166.602 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.34 -38.46 91.22 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.465 0.913 . . . . 10.0 113.465 -172.601 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.0 pt -131.69 117.72 16.48 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.773 0.829 . . . . 10.0 110.767 171.723 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.19 104.37 1.66 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.574 2.85 . . . . 10.0 111.798 -172.1 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.68 82.31 1.62 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.032 0.825 . . . . 10.0 111.594 178.189 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -133.22 -19.38 2.2 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.253 1.946 . . . . 10.0 116.253 -169.812 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 55.47 2.29 0.06 Allowed 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 117.039 2.236 . . . . 10.0 117.039 173.461 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.2 ttt -62.93 81.45 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 120.302 1.41 . . . . 10.0 110.081 161.873 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.49 90.26 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.956 1.303 . . . . 10.0 109.359 176.063 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -161.6 -68.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 118.32 -0.848 . . . . 10.0 112.825 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.17 89.08 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 127.237 2.215 . . . . 10.0 116.527 172.775 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.38 92.56 2.05 Favored Glycine 0 CA--C 1.532 1.101 0 O-C-N 121.691 -0.631 . . . . 10.0 113.179 175.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 17.8 tt -64.38 -36.82 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 115.808 1.781 . . . . 10.0 115.808 -167.498 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttm 164.41 -165.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 129.413 3.085 . . . . 10.0 108.501 -161.665 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.51 ' HE2' ' HG2' ' A' ' 90' ' ' GLU . 40.8 pttt -52.63 153.32 3.19 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.973 1.709 . . . . 10.0 110.91 167.088 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -73.16 71.45 1.16 Allowed 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 123.325 1.536 . . . . 10.0 110.774 171.656 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.3 m -151.89 -54.34 0.13 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 125.903 1.681 . . . . 10.0 108.259 169.587 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG2' ' HE2' ' A' ' 87' ' ' LYS . 18.6 mm-40 -56.7 -38.83 72.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.762 0.71 . . . . 10.0 111.313 172.47 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -30.98 71.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.153 0.581 . . . . 10.0 111.907 174.92 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.05 -36.08 61.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.068 0.947 . . . . 10.0 111.239 173.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.59 -48.08 70.69 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.646 1.978 . . . . 10.0 111.186 175.35 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.23 -53.91 30.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.949 2.1 . . . . 10.0 112.668 174.681 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.26 -38.88 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 122.781 0.432 . . . . 10.0 110.274 -178.763 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.7 99.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 122.525 0.33 . . . . 10.0 111.647 173.375 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.401 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -56.6 -60.85 2.93 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.476 1.11 . . . . 10.0 111.195 172.287 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 60.2 mt -61.04 -36.78 80.48 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.543 1.065 . . . . 10.0 112.728 -175.626 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.91 -32.57 61.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 117.891 -1.052 . . . . 10.0 112.721 174.478 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -101.13 -35.79 9.19 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 175.584 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.61 -27.53 64.77 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.969 1.713 . . . . 10.0 113.506 -178.262 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.9 t -65.38 -11.65 44.4 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.835 1.254 . . . . 10.0 114.363 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.71 51.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.031 2.132 . . . . 10.0 111.029 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 113.388 0.885 . . . . 10.0 113.388 172.026 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.29 119.88 19.25 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.814 1.246 . . . . 10.0 110.501 -161.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.472 HG23 ' HA ' ' A' ' 97' ' ' TYR . 7.3 p -56.24 -34.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 O-C-N 121.48 -0.763 . . . . 10.0 111.294 172.482 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.2 mp0 -60.72 -48.02 83.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 126.528 1.931 . . . . 10.0 111.164 -171.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mtmp? -75.68 -23.64 56.23 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.069 1.748 . . . . 10.0 113.568 167.579 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.27 -46.42 7.54 Favored Glycine 0 N--CA 1.464 0.555 0 O-C-N 121.236 -0.915 . . . . 10.0 111.78 -168.54 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -41.48 50.79 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.923 1.289 . . . . 10.0 113.408 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -71.72 -37.86 70.57 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.709 -1.139 . . . . 10.0 113.763 179.228 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.27 -35.61 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 120.372 1.442 . . . . 10.0 109.996 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.436 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 32.6 t80 -57.08 -51.11 70.61 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.222 0.919 . . . . 10.0 110.624 173.606 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.22 -16.63 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 113.968 1.099 . . . . 10.0 113.968 177.033 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.2 -34.76 25.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.535 1.134 . . . . 10.0 111.953 -173.768 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -136.53 -58.95 0.73 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.799 1.639 . . . . 10.0 110.334 -163.626 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 8.9 m -58.45 -45.9 87.64 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.806 1.243 . . . . 10.0 111.999 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -8.78 17.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.713 1.375 . . . . 10.0 114.713 175.497 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -10.22 59.48 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.01 -1.056 . . . . 10.0 112.412 169.774 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 87.3 m -142.87 -27.55 0.58 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -173.024 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -116.72 168.12 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.333 2.253 . . . . 10.0 112.956 -176.251 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -136.07 137.78 41.45 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.859 1.263 . . . . 10.0 109.855 165.825 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.2 p -166.26 -32.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.923 1.289 . . . . 10.0 111.738 172.364 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -48.21 -38.06 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.36 2.264 . . . . 10.0 115.311 175.615 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.46 148.47 16.38 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.489 1.916 . . . . 10.0 108.14 168.346 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 -143.21 48.35 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-O 121.583 0.546 . . . . 10.0 112.05 -172.336 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.5 118.21 0.53 Allowed Glycine 0 CA--C 1.527 0.806 0 C-N-CA 125.084 1.326 . . . . 10.0 111.575 -176.448 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -164.33 167.78 19.41 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.376 2.27 . . . . 10.0 109.008 178.786 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.89 148.94 28.4 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 121.349 -0.844 . . . . 10.0 111.689 -173.767 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -143.91 -34.82 0.38 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.119 1.768 . . . . 10.0 113.399 -174.172 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.422 ' O ' HMD3 ' A' ' 105' ' ' HEC . 1.4 m -150.9 -21.17 0.22 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.433 0.693 . . . . 10.0 111.604 -169.032 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.97 167.06 22.97 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 109.782 -1.327 . . . . 10.0 109.782 149.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.0 155.49 52.78 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 10.0 112.135 179.722 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.69 129.68 40.73 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.068 -1.02 . . . . 10.0 109.82 165.543 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.32 70.36 2.92 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.571 1.653 . . . . 10.0 112.592 -167.311 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.65 88.61 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.583 1 C-N-CA 132.576 4.35 . . . . 10.0 115.112 -178.931 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.58 27.23 70.62 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.245 0.926 . . . . 10.0 114.938 162.652 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.5 mp -53.37 166.06 0.31 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.834 1.654 . . . . 10.0 111.905 178.946 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 29.1 m-85 65.36 59.37 0.8 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.007 1.723 . . . . 10.0 113.246 -174.067 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 161.35 -46.01 0.38 Allowed Glycine 0 CA--C 1.53 0.986 0 CA-C-N 115.533 -0.758 . . . . 10.0 114.187 167.167 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.11 169.51 13.06 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.976 0.91 . . . . 10.0 112.13 177.086 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.1 pttm -74.74 -20.52 59.79 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 115.055 1.502 . . . . 10.0 115.055 -165.828 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.453 HG21 ' H ' ' A' ' 59' ' ' TRP 0.288 29.6 p 88.05 167.5 0.06 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 129.417 3.087 . . . . 10.0 112.659 175.449 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 70.21 116.77 0.04 OUTLIER Glycine 0 CA--C 1.541 1.664 0 C-N-CA 123.109 0.385 . . . . 10.0 112.217 -154.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -159.45 4.87 0.09 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.393 1.877 . . . . 10.0 113.861 168.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -50.86 108.98 1.16 Allowed Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 125.966 1.707 . . . . 10.0 114.651 -164.821 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.6 65.61 8.09 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.386 3.391 . . . . 10.0 112.944 -171.459 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 107.64 60.26 0.56 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.798 1.19 . . . . 10.0 113.171 174.553 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -143.81 169.66 17.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.182 1.393 . . . . 10.0 109.607 177.286 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -153.25 151.79 30.44 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.585 0.754 . . . . 10.0 110.772 177.825 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.402 ' CD2' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -157.76 -92.89 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 10.0 111.22 -153.899 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -145.8 -1.64 0.77 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.129 2.172 . . . . 10.0 114.106 -177.006 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 45.46 -95.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.923 2.089 . . . . 10.0 112.613 -157.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 30.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.697 3.199 . . . . 10.0 115.558 170.869 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -43.95 -56.61 3.82 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.782 2.033 . . . . 10.0 111.695 174.206 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.402 ' HE3' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -62.01 -40.09 94.49 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.263 1.825 . . . . 10.0 111.087 -177.397 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -63.41 -48.6 77.13 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.227 1.411 . . . . 10.0 111.533 176.259 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -62.18 -24.09 66.99 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.714 1.206 . . . . 10.0 113.701 -174.606 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.4 36.66 93.68 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.375 0.989 . . . . 10.0 114.184 171.083 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -1.44 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.869 2.067 . . . . 10.0 116.084 -174.486 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.8 m 56.27 92.59 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.606 1.963 . . . . 10.0 113.184 -179.689 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.632 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 10.5 m95 -58.68 125.75 24.75 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.427 168.954 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.424 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 0.6 OUTLIER -162.76 178.62 8.31 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.782 2.833 . . . . 10.0 109.177 -178.237 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -67.17 35.36 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 129.637 3.175 . . . . 10.0 114.574 -172.794 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -160.89 -63.8 0.06 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 127.904 2.482 . . . . 10.0 108.432 -174.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.5 p -57.92 -46.93 84.25 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.116 1.366 . . . . 10.0 111.673 179.484 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.44 -29.09 66.72 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.563 1.145 . . . . 10.0 111.783 175.519 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 30.3 ttm -68.77 -43.69 75.24 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 118.275 0.489 . . . . 10.0 111.105 175.663 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -67.91 -45.79 73.37 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 117.908 0.322 . . . . 10.0 110.184 173.305 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.5 -57.72 11.53 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 118.107 -0.949 . . . . 10.0 112.45 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -34.05 76.72 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.549 1.522 . . . . 10.0 111.904 -174.573 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -73.02 -22.05 60.72 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.634 1.716 . . . . 10.0 115.634 175.265 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -161.47 63.15 1.61 Allowed Pre-proline 0 CA--C 1.556 1.189 0 CA-C-N 120.156 1.344 . . . . 10.0 114.384 178.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.208 1.939 . . . . 10.0 113.072 -159.18 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -71.17 -20.47 62.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.703 2.001 . . . . 10.0 112.745 -178.248 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.23 -51.99 10.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.521 1.129 . . . . 10.0 110.231 164.149 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -60.49 -44.99 95.37 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.87 1.063 . . . . 10.0 113.87 -173.619 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 pt -137.08 124.35 14.07 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.992 . . . . 10.0 110.436 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -78.07 60.24 7.28 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.407 3.405 . . . . 10.0 112.696 -167.546 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.85 66.38 0.04 OUTLIER Glycine 0 CA--C 1.523 0.584 0 O-C-N 121.567 -0.708 . . . . 10.0 113.338 179.152 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 4.5 m -135.91 125.35 25.0 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.886 0.874 . . . . 10.0 111.871 173.993 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -86.39 -3.53 59.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.783 1.401 . . . . 10.0 114.783 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.1 ttt -50.11 101.83 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.972 1.709 . . . . 10.0 113.7 -174.816 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 27.3 mm -78.22 72.96 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.224 1.41 . . . . 10.0 109.583 175.596 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -163.58 -49.42 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.851 1.26 . . . . 10.0 111.139 169.431 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.93 32.53 1.35 Allowed 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 118.081 2.623 . . . . 10.0 118.081 164.52 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 179.0 -161.11 27.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.965 1.269 . . . . 10.0 111.441 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.2 tt -147.68 -175.37 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.554 0.742 . . . . 10.0 111.71 165.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -77.89 -30.47 50.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.939 1.296 . . . . 10.0 114.492 -164.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -161.63 -68.96 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 116.588 -1.672 . . . . 10.0 111.755 -170.069 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 pttm 174.98 -40.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.777 2.031 . . . . 10.0 115.815 164.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 m -58.39 -30.3 66.71 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.732 1.606 . . . . 10.0 112.04 -178.657 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.3 mp0 -59.42 -29.08 67.5 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.23 -0.919 . . . . 10.0 112.366 173.044 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -67.13 -55.57 13.66 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 119.189 0.904 . . . . 10.0 111.63 -178.476 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -61.06 -34.67 75.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.933 1.293 . . . . 10.0 111.618 175.152 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -67.33 -45.9 75.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.145 0.884 . . . . 10.0 112.545 174.87 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.483 HD23 HMB1 ' A' ' 105' ' ' HEC . 7.5 mp -65.14 -38.36 90.36 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.334 -0.854 . . . . 10.0 113.019 174.744 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mt -61.16 -51.21 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 118.566 -0.73 . . . . 10.0 109.6 170.941 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -41.64 85.31 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.876 0.762 . . . . 10.0 112.557 177.919 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.472 ' HA ' HG23 ' A' ' 3' ' ' VAL . 2.7 t80 -50.36 -65.73 0.51 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 124.407 1.083 . . . . 10.0 111.557 169.414 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.4 -36.01 82.3 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.491 0.587 . . . . 10.0 112.131 -175.908 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -65.75 -21.61 66.53 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.423 1.489 . . . . 10.0 114.263 176.029 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -87.79 -52.56 5.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.466 1.03 . . . . 10.0 111.422 160.877 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -26.05 52.97 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 -170.795 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.5 t -74.11 -1.86 22.03 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.42 1.488 . . . . 10.0 114.126 172.674 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -154.08 -18.61 0.13 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 117.12 2.267 . . . . 10.0 117.12 -178.621 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.074 -1.917 . . . . 10.0 114.561 177.952 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.632 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 CA-C-O 118.828 -0.984 . . . . 10.0 111.347 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -140.74 160.12 40.73 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.287 1.588 . . . . 10.0 115.287 -149.023 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.17 -53.0 54.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 125.817 1.647 . . . . 10.0 112.749 -179.22 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -44.45 97.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.786 1.176 . . . . 10.0 113.335 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -56.13 -36.22 68.0 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.675 0.75 . . . . 10.0 110.793 172.387 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.37 -51.42 6.7 Favored Glycine 0 C--O 1.224 -0.512 0 C-N-CA 125.248 1.404 . . . . 10.0 110.288 -173.724 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -37.52 83.38 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.111 1.456 . . . . 10.0 112.637 177.248 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -59.94 -56.79 17.33 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.625 0.77 . . . . 10.0 111.594 174.724 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -31.76 47.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 118.438 0.563 . . . . 10.0 111.816 -178.45 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -56.41 -51.08 69.69 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.371 -1.455 . . . . 10.0 110.576 168.48 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.68 -15.53 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 113.682 0.993 . . . . 10.0 113.682 178.375 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -90.09 -43.6 10.38 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.025 1.33 . . . . 10.0 111.78 -179.631 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -119.2 -11.37 9.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.932 1.456 . . . . 10.0 114.932 -169.591 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -120.32 -44.17 2.49 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.451 1.5 . . . . 10.0 111.434 -172.345 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.31 -11.17 20.03 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.696 0.998 . . . . 10.0 113.696 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.25 -25.95 26.18 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.953 2.101 . . . . 10.0 112.553 164.04 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.8 m -141.68 -19.29 0.75 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 10.0 113.629 -173.378 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.43 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 92.3 m-70 -130.25 86.16 2.37 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 10.0 110.897 -177.067 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.2 p -69.69 18.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.574 2.064 . . . . 10.0 116.574 -167.467 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.71 -35.07 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 O-C-N 120.642 -1.286 . . . . 10.0 113.509 -160.509 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -62.99 -0.84 0.76 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.131 1.772 . . . . 10.0 114.271 177.077 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -150.28 13.68 0.77 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.109 2.164 . . . . 10.0 111.561 178.128 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.13 -73.18 0.13 Allowed Glycine 0 CA--C 1.532 1.126 0 C-N-CA 125.137 1.351 . . . . 10.0 112.312 -169.686 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.37 -119.17 8.72 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 126.545 2.022 . . . . 10.0 112.442 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 165.87 22.25 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.728 2.011 . . . . 10.0 110.454 169.306 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -64.9 81.05 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.746 1.219 . . . . 10.0 112.665 178.467 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -68.86 -31.1 69.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.53 1.532 . . . . 10.0 112.512 179.67 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.8 m -155.07 -23.75 0.12 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.254 -0.879 . . . . 10.0 113.248 172.589 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.43 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -124.98 170.99 16.95 Favored Glycine 0 CA--C 1.54 1.653 0 CA-C-N 119.657 1.117 . . . . 10.0 111.95 167.125 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.24 44.18 1.6 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 124.908 3.739 . . . . 10.0 113.969 -153.197 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 48.14 18.84 0.16 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.172 2.189 . . . . 10.0 115.963 -178.378 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt 33.37 64.6 0.3 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.964 2.905 . . . . 10.0 112.835 -179.181 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -54.11 80.48 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.83 2.452 . . . . 10.0 111.748 172.098 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.04 -47.89 0.07 OUTLIER Glycine 0 CA--C 1.536 1.358 0 C-N-CA 129.827 3.584 . . . . 10.0 116.237 -179.176 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.51 ' CD2' HMA3 ' A' ' 105' ' ' HEC 0.276 8.6 mp 53.78 -148.8 0.44 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.533 1.933 . . . . 10.0 110.295 -165.67 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 34.8 59.52 0.68 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.148 2.179 . . . . 10.0 114.959 178.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 115.81 -27.2 8.43 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.693 2.092 . . . . 10.0 113.17 -174.621 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -69.49 74.26 0.38 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.071 1.348 . . . . 10.0 111.344 170.087 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt 34.03 -125.25 0.09 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 129.927 3.291 . . . . 10.0 113.776 161.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.41 HG22 ' HA ' ' A' ' 53' ' ' LYS . 3.7 m -149.52 -79.62 0.13 Allowed 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.163 -1.585 . . . . 10.0 109.742 171.927 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.59 88.47 0.73 Allowed Glycine 0 CA--C 1.535 1.296 0 O-C-N 120.357 -1.464 . . . . 10.0 115.541 179.816 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -134.4 9.53 3.72 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.452 1.279 . . . . 10.0 114.452 -178.085 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.8 140.34 93.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 121.031 -1.043 . . . . 10.0 112.266 -176.735 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -77.61 52.34 3.91 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 124.104 3.203 . . . . 10.0 112.876 -177.382 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.88 -96.49 0.37 Allowed Glycine 0 CA--C 1.527 0.785 0 C-N-CA 126.347 1.927 . . . . 10.0 110.869 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.7 t80 32.8 100.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.758 2.823 . . . . 10.0 117.234 165.856 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 m -66.33 90.25 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.168 -0.957 . . . . 10.0 112.258 168.173 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -83.13 174.0 11.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.298 1.439 . . . . 10.0 110.447 161.753 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.0 p -74.42 30.88 0.08 Allowed 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -174.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.5 t70 45.73 -69.02 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 129.849 3.259 . . . . 10.0 115.593 -166.422 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.04 -45.73 61.4 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.026 1.73 . . . . 10.0 113.552 -150.29 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -45.9 -70.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.38 1.472 . . . . 10.0 111.748 171.323 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HZ3' ' CGA' ' A' ' 105' ' ' HEC . 18.9 mtpp -71.19 -25.37 62.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.581 1.552 . . . . 10.0 112.447 -171.197 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.56 -45.93 92.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.51 1.524 . . . . 10.0 112.697 161.672 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.71 -24.13 65.35 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.27 0.941 . . . . 10.0 113.184 -170.198 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.77 26.9 70.19 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-O 119.1 -0.833 . . . . 10.0 115.072 163.46 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -3.96 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 115.847 1.795 . . . . 10.0 115.847 -171.615 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.4 m 57.86 108.9 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.565 2.346 . . . . 10.0 114.002 -170.551 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.413 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 25.1 m95 -67.24 119.76 12.67 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.284 -0.871 . . . . 10.0 112.349 173.067 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -166.63 -175.92 3.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.742 2.817 . . . . 10.0 108.768 175.894 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -45.59 -53.08 9.63 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.645 1.578 . . . . 10.0 111.635 176.689 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.67 15.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.862 2.065 . . . . 10.0 116.047 -174.833 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.9 p -157.73 -39.26 0.07 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.94 -1.1 . . . . 10.0 110.879 -169.221 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -30.19 59.65 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.181 1.355 . . . . 10.0 112.787 174.841 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -51.03 58.46 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 119.613 1.097 . . . . 10.0 108.616 174.743 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.81 -37.74 87.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.506 0.722 . . . . 10.0 110.653 -179.807 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -66.06 -65.38 0.68 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.403 -0.808 . . . . 10.0 112.561 173.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -17.26 64.71 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.818 1.645 . . . . 10.0 114.301 -172.756 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.93 -32.05 71.38 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.806 1.185 . . . . 10.0 113.557 165.488 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -163.23 79.31 1.67 Allowed Pre-proline 0 CA--C 1.549 0.933 0 CA-C-N 119.754 1.161 . . . . 10.0 111.642 177.262 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.36 -52.25 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.189 1.926 . . . . 10.0 110.873 -163.919 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -67.78 24.88 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.767 2.827 . . . . 10.0 114.568 -177.941 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.91 -28.8 0.06 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.921 2.089 . . . . 10.0 111.894 -175.081 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -64.62 -38.6 91.56 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 119.273 0.942 . . . . 10.0 112.006 165.376 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.4 pt -133.78 151.08 76.34 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 124.239 1.016 . . . . 10.0 111.381 176.039 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.1 162.2 41.36 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.725 2.284 . . . . 10.0 111.213 173.973 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 39.7 61.85 1.51 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.955 1.74 . . . . 10.0 114.775 172.926 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.9 t -121.08 -14.41 8.41 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.101 1.519 . . . . 10.0 115.101 178.198 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? 54.5 -67.14 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 127.668 2.387 . . . . 10.0 116.071 179.219 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.1 ttt 13.53 85.17 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 130.961 3.704 . . . . 10.0 113.838 -177.15 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -70.53 80.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.856 1.263 . . . . 10.0 109.553 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -162.95 -51.83 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.455 1.502 . . . . 10.0 111.19 172.086 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 35.15 57.6 0.79 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.845 2.458 . . . . 10.0 116.449 170.789 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 161.41 -166.96 36.11 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.457 1.027 . . . . 10.0 111.594 179.446 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 tt -158.08 178.15 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.826 1.65 . . . . 10.0 109.475 166.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -88.9 166.96 13.61 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.844 1.202 . . . . 10.0 111.047 178.062 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . 0.258 8.6 ptpp? 40.21 -103.53 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.602 1.961 . . . . 10.0 112.153 -172.522 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.2 tttp -163.17 -32.95 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.828 1.251 . . . . 10.0 112.578 154.003 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.9 m -59.06 -21.39 59.09 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 -178.882 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -54.64 -32.77 59.57 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.067 -1.021 . . . . 10.0 112.354 167.444 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.35 -22.36 61.17 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.226 1.411 . . . . 10.0 112.744 175.423 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.26 -53.91 7.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.238 1.015 . . . . 10.0 110.402 164.509 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.65 1.58 . . . . 10.0 111.735 -169.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 mp -53.69 -42.95 68.52 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 114.499 1.296 . . . . 10.0 114.499 173.668 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.8 mm -66.09 -50.86 66.06 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.238 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.132 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.42 66.28 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.916 -1.04 . . . . 10.0 113.301 179.471 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -66.51 -69.2 0.32 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.67 1.988 . . . . 10.0 112.557 159.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.79 -20.6 63.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.085 0.772 . . . . 10.0 113.085 -173.785 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.17 -35.52 62.4 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.883 2.073 . . . . 10.0 113.371 166.815 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -81.27 -46.0 15.42 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.037 1.335 . . . . 10.0 110.874 171.399 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.2 -1.02 0.27 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.453 2.39 . . . . 10.0 117.453 -166.938 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.7 t -133.85 15.42 3.94 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.838 1.255 . . . . 10.0 114.227 168.4 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -151.02 -13.48 0.22 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.767 1.627 . . . . 10.0 114.172 -169.804 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.949 1.699 . . . . 10.0 114.25 177.214 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.51 HMA3 ' CD2' ' A' ' 35' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.942 0 CA-C-O 117.914 -1.492 . . . . 10.0 111.792 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -139.53 164.59 29.48 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.119 1.459 . . . . 10.0 114.823 -173.601 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.4 t -75.29 -61.22 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 126.281 1.832 . . . . 10.0 109.879 165.355 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -60.0 -47.36 86.14 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.986 -1.071 . . . . 10.0 113.531 -175.236 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -59.16 -31.47 69.01 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 117.871 0.305 . . . . 10.0 111.226 172.918 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.23 -50.94 19.82 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 125.858 1.694 . . . . 10.0 111.379 178.692 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -32.7 74.36 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 117.879 0.84 . . . . 10.0 111.813 -179.337 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -63.26 -55.2 26.84 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.802 1.241 . . . . 10.0 111.413 173.055 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.251 0.2 OUTLIER -68.3 -30.17 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 CA-C-N 118.473 0.579 . . . . 10.0 111.747 -179.474 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -56.35 -54.06 49.93 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 120.468 -1.395 . . . . 10.0 110.83 164.809 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.2 t -62.23 -13.93 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 O-C-N 121.308 -0.87 . . . . 10.0 113.209 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -91.93 -42.16 10.19 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.641 1.177 . . . . 10.0 112.285 178.508 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -124.44 -3.06 7.93 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.63 1.715 . . . . 10.0 115.63 -168.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.7 m -120.67 -43.9 2.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.909 1.684 . . . . 10.0 111.0 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.64 -4.37 8.62 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.493 1.294 . . . . 10.0 114.493 176.304 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.47 -12.38 60.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.64 1.176 . . . . 10.0 113.964 164.885 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.63 -40.57 0.29 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.622 1.569 . . . . 10.0 112.49 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.468 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.5 m-70 -93.68 -161.61 0.86 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 127.504 2.322 . . . . 10.0 109.034 166.246 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 m -154.8 -55.07 0.1 Allowed 'General case' 0 N--CA 1.482 1.175 0 O-C-N 119.847 -1.783 . . . . 10.0 112.574 165.281 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t 61.2 -71.75 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.085 1.754 . . . . 10.0 114.422 177.568 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.35 -52.75 64.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.342 1.057 . . . . 10.0 111.769 -166.817 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -153.17 100.27 2.45 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.953 1.301 . . . . 10.0 110.582 -171.399 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.79 -7.73 8.25 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 117.003 1.561 . . . . 10.0 117.003 165.505 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.95 7.03 21.05 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.765 1.782 . . . . 10.0 117.33 169.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -75.0 75.36 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.633 2.373 . . . . 10.0 113.706 -164.146 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -64.27 62.17 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 128.551 2.74 . . . . 10.0 113.647 172.848 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.04 -21.0 65.94 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.321 -1.487 . . . . 10.0 113.667 176.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -154.4 -1.03 0.19 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.665 1.121 . . . . 10.0 114.019 174.024 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.468 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -148.89 156.61 26.92 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-N 120.681 1.582 . . . . 10.0 112.328 167.656 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.99 3.91 3.6 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 124.79 3.66 . . . . 10.0 117.088 -151.04 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 64.32 149.12 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.482 2.713 . . . . 10.0 112.654 -144.646 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -83.54 50.0 1.7 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.647 1.179 . . . . 10.0 110.691 176.135 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.46 98.45 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 128.267 2.627 . . . . 10.0 113.821 -173.92 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 17.96 68.02 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.562 1.077 . . . . 10.0 114.651 173.894 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -61.06 172.28 1.05 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 118.914 1.357 . . . . 10.0 112.015 179.354 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.281 77.5 m-85 71.38 68.25 0.16 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.395 1.878 . . . . 10.0 111.614 -163.972 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.2 -23.45 5.19 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 126.731 2.11 . . . . 10.0 113.215 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mtp85 -77.68 162.51 26.95 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.401 1.096 . . . . 10.0 112.557 173.715 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HD2' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -73.75 179.02 4.42 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.459 2.304 . . . . 10.0 111.765 171.74 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.3 p -73.82 174.87 7.86 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.295 1.038 . . . . 10.0 109.439 161.294 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.39 -179.37 37.52 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-O 121.788 0.66 . . . . 10.0 111.717 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 65.32 166.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.563 1.945 . . . . 10.0 114.696 -176.544 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 162.36 167.38 0.05 OUTLIER Pre-proline 0 CA--C 1.546 0.824 1 C-N-CA 133.216 4.607 . . . . 10.0 105.212 -169.222 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.77 -143.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.55 1.318 0 C-N-CA 122.538 2.159 . . . . 10.0 108.927 146.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.88 18.94 0.17 Allowed Glycine 0 CA--C 1.544 1.862 0 N-CA-C 117.447 1.739 . . . . 10.0 117.447 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -77.35 106.06 8.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.443 1.622 . . . . 10.0 110.893 175.695 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 m -65.61 138.64 58.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.13 1.372 . . . . 10.0 111.567 173.435 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.452 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.46 -178.94 6.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.519 1.528 . . . . 10.0 112.3 -175.126 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.3 p -71.78 164.35 26.15 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.203 0.601 . . . . 10.0 111.805 167.819 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -75.48 -111.24 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.236 -0.915 . . . . 10.0 109.847 163.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 35.81 -87.34 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 130.086 3.354 . . . . 10.0 115.051 168.883 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -45.82 -56.97 4.7 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.209 1.403 . . . . 10.0 112.738 170.428 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -63.5 -35.78 81.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.227 0.611 . . . . 10.0 111.27 -175.71 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.21 -43.76 85.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.643 2.377 . . . . 10.0 113.417 172.641 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -21.94 55.09 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.851 1.797 . . . . 10.0 115.851 -167.86 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.06 -7.54 63.08 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 116.24 1.256 . . . . 10.0 116.24 159.788 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.6 pp -56.77 141.71 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 118.61 1.205 . . . . 10.0 111.966 -177.081 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.8 m -67.83 117.9 10.34 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 121.641 -0.662 . . . . 10.0 110.013 -178.288 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -71.18 113.55 8.33 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 170.925 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.62 179.52 7.14 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 10.0 111.887 -168.642 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -69.74 42.91 0.05 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.279 1.831 . . . . 10.0 115.207 -172.649 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -160.23 -66.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.132 2.173 . . . . 10.0 108.254 -176.372 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.0 p -57.22 -38.24 73.45 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 126.594 1.958 . . . . 10.0 112.731 -179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.57 -23.25 56.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 10.0 113.035 176.772 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -51.91 30.63 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.151 1.341 . . . . 10.0 108.466 169.454 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.2 -43.72 98.43 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 123.431 0.457 . . . . 10.0 110.315 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.61 -57.88 10.83 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 118.304 -0.855 . . . . 10.0 111.931 175.298 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.76 -28.79 67.11 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 120.288 1.404 . . . . 10.0 113.645 -172.114 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -78.88 -19.58 51.58 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.521 1.304 . . . . 10.0 114.521 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.4 60.73 1.43 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.37 1.068 . . . . 10.0 110.856 -167.681 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.95 -58.85 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.519 2.146 . . . . 10.0 111.343 -168.142 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -70.63 38.2 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 129.034 2.934 . . . . 10.0 113.174 179.206 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.07 -49.52 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 128.391 2.676 . . . . 10.0 108.828 -169.391 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -62.18 -36.78 82.92 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.907 0.321 . . . . 10.0 111.539 174.684 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.82 154.59 73.01 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 126.163 1.785 . . . . 10.0 108.72 166.122 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.43 164.81 34.52 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 121.65 1.566 . . . . 10.0 110.425 165.592 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.32 66.84 2.33 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.184 -0.787 . . . . 10.0 114.208 168.356 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -129.49 -33.26 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.786 1.773 . . . . 10.0 115.786 172.68 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 62.78 -63.26 0.11 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 116.954 -1.498 . . . . 10.0 113.889 -170.5 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.1 ttt 10.27 91.29 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 129.715 3.206 . . . . 10.0 114.512 -173.098 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 19.9 mm -72.51 74.2 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 125.376 1.47 . . . . 10.0 110.895 -175.964 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -163.29 -49.46 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.615 1.566 . . . . 10.0 112.101 169.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.83 78.62 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.717 2.407 . . . . 10.0 115.576 172.876 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.62 -159.48 25.86 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.206 1.384 . . . . 10.0 112.916 -176.675 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.9 tt -153.84 -178.66 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.376 1.47 . . . . 10.0 109.812 157.046 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -76.36 -87.2 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.804 1.242 . . . . 10.0 114.003 -166.941 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -65.74 0.9 Allowed 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.669 1.577 . . . . 10.0 111.342 -176.107 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.6 pttt 174.57 -61.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.905 2.482 . . . . 10.0 111.721 176.574 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.4 m -59.46 -20.72 57.36 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 -173.209 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -56.3 -26.99 54.06 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.081 0.855 . . . . 10.0 112.529 168.485 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -50.07 75.21 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 125.025 1.33 . . . . 10.0 110.898 172.285 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -62.72 -48.36 79.58 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.052 1.341 . . . . 10.0 110.222 176.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -59.88 -48.62 80.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.516 1.126 . . . . 10.0 111.773 -172.644 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mp -54.99 -49.64 70.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.19 0.811 . . . . 10.0 113.19 173.371 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.2 mm -62.67 -45.76 98.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 123.264 0.625 . . . . 10.0 109.69 -178.024 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.88 -46.86 86.84 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.817 1.247 . . . . 10.0 112.236 174.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.12 -59.95 4.19 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.875 0.87 . . . . 10.0 111.273 173.988 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.24 -37.95 89.3 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -173.51 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -62.06 -24.45 67.1 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.04 0.936 . . . . 10.0 112.852 176.956 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.51 -59.06 2.49 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.517 1.527 . . . . 10.0 111.896 165.485 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.61 -32.52 63.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.63 1.572 . . . . 10.0 114.588 -171.361 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -54.61 -32.27 58.52 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 174.845 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -87.93 -20.3 26.11 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.171 1.388 . . . . 10.0 114.372 177.957 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 116.128 -1.892 . . . . 10.0 112.939 -140.714 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.428 ' CGD' ' HE3' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 110.063 -1.215 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.503 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.7 OUTLIER -134.03 96.17 3.58 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.231 1.413 . . . . 10.0 107.447 -152.579 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.9 p -49.49 -39.02 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.679 1.592 . . . . 10.0 113.853 -162.43 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 53.4 mp0 -71.13 -32.65 69.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.85 1.26 . . . . 10.0 113.987 178.843 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.3 mttt -75.68 -28.31 58.61 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 125.252 1.421 . . . . 10.0 111.436 174.53 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.61 -42.42 93.45 Favored Glycine 0 C--N 1.334 0.462 0 N-CA-C 109.951 -1.26 . . . . 10.0 109.951 -173.36 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -62.87 -41.52 99.42 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.85 0.685 . . . . 10.0 112.85 173.099 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -62.21 -54.86 34.84 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.812 1.645 . . . . 10.0 111.323 179.406 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 tp -69.23 -33.4 57.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 122.637 0.375 . . . . 10.0 111.577 -179.192 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -57.67 -49.7 75.61 Favored 'General case' 0 C--N 1.344 0.356 0 O-C-N 121.663 -0.648 . . . . 10.0 110.672 168.335 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.41 -15.52 10.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.054 -1.029 . . . . 10.0 113.72 178.567 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -92.69 -41.8 9.96 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.291 1.037 . . . . 10.0 112.644 -179.527 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -117.94 -11.12 10.29 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.749 1.389 . . . . 10.0 114.749 -171.442 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.4 m -122.64 -45.94 2.15 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.404 1.482 . . . . 10.0 111.239 -169.739 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.94 -16.4 42.07 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 175.289 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -20.62 10.42 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 129.996 3.318 . . . . 10.0 113.699 166.464 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.9 m -142.46 -15.29 0.75 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.763 2.025 . . . . 10.0 113.443 178.413 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -133.43 62.11 1.66 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.691 2.397 . . . . 10.0 109.854 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -64.42 114.93 4.64 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.597 -1.314 . . . . 10.0 109.943 -177.293 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LEU . 24.5 t -140.9 -49.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.675 1.19 . . . . 10.0 111.676 -160.791 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.12 -10.36 1.17 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.021 1.328 . . . . 10.0 113.912 -177.372 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -150.15 15.56 0.82 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.486 2.714 . . . . 10.0 110.437 -179.434 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.57 165.35 2.75 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 127.501 2.477 . . . . 10.0 115.232 -174.902 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 174.2 150.6 7.76 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.262 0.934 . . . . 10.0 113.803 169.627 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.84 59.86 1.66 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 115.209 1.559 . . . . 10.0 115.209 -171.613 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 m170 64.26 -64.79 0.14 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.79 2.836 . . . . 10.0 114.438 171.9 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt 61.17 -48.57 0.12 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 129.986 3.314 . . . . 10.0 116.052 178.07 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.77 -7.42 0.23 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.209 1.404 . . . . 10.0 112.613 -170.025 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -152.38 169.46 31.58 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.213 1.387 . . . . 10.0 110.648 171.112 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -72.29 9.62 1.13 Allowed 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.983 3.122 . . . . 10.0 115.238 -169.468 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 47.14 162.1 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 129.566 3.146 . . . . 10.0 114.39 -149.408 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.459 ' HB2' HG21 ' A' ' 20' ' ' VAL . 3.6 mm? -80.43 76.08 7.26 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.117 -0.99 . . . . 10.0 108.395 170.956 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -65.6 -174.01 0.18 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.929 1.292 . . . . 10.0 110.814 166.273 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.22 119.79 2.07 Favored Glycine 0 CA--C 1.537 1.426 0 O-C-N 121.24 -0.913 . . . . 10.0 112.205 166.899 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.45 -165.34 1.49 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 129.636 3.175 . . . . 10.0 109.137 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.309 76.6 m-85 63.4 -17.38 0.06 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.313 3.045 . . . . 10.0 118.774 173.075 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -138.69 -25.7 0.31 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 127.092 2.282 . . . . 10.0 113.432 163.539 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.4 170.28 12.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.946 1.299 . . . . 10.0 113.159 177.742 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.18 161.79 17.86 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.962 -1.086 . . . . 10.0 113.395 177.318 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.5 m -77.79 144.09 37.41 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.699 1.6 . . . . 10.0 110.539 179.091 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.18 0.39 65.69 Favored Glycine 0 N--CA 1.472 1.098 0 N-CA-C 115.652 1.021 . . . . 10.0 115.652 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -71.19 49.28 0.14 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 127.208 2.203 . . . . 10.0 113.81 -179.289 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.26 137.24 71.91 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 128.169 2.588 . . . . 10.0 113.394 -178.263 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.63 46.55 1.89 Allowed 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 123.505 2.803 . . . . 10.0 112.758 173.189 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.55 80.39 1.18 Allowed Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.628 1.585 . . . . 10.0 114.732 173.478 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -153.07 125.69 8.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.539 1.135 . . . . 10.0 111.425 173.16 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -79.93 87.78 5.34 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.851 1.261 . . . . 10.0 111.897 179.1 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.83 176.86 8.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.48 1.512 . . . . 10.0 112.513 166.25 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 49' ' ' THR . 0.3 OUTLIER -64.62 131.06 45.91 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.684 1.994 . . . . 10.0 109.898 158.766 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -75.13 -159.66 0.1 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.128 0.971 . . . . 10.0 111.67 172.329 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.38 -69.49 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.658 1.983 . . . . 10.0 113.524 -169.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.512 HD21 ' HA3' ' A' ' 77' ' ' GLY . 7.7 p30 -51.23 -51.36 54.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.383 1.873 . . . . 10.0 112.747 174.43 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HA ' ' HE2' ' A' ' 53' ' ' LYS . 1.8 mmpt? -72.1 -42.59 65.92 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.592 1.157 . . . . 10.0 113.107 170.584 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.6 -41.19 69.65 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.812 0.845 . . . . 10.0 112.75 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.85 -11.62 60.43 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.379 1.252 . . . . 10.0 114.379 176.889 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.97 9.02 55.77 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 118.182 2.033 . . . . 10.0 118.182 151.397 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.8 pp -40.64 10.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.236 2 C-N-CA 135.274 5.43 . . . . 10.0 121.893 -154.958 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.3 m 57.03 109.67 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 128.361 2.664 . . . . 10.0 114.646 -173.761 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.475 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 31.2 m95 -71.28 134.53 46.87 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.575 -1.193 . . . . 10.0 112.091 166.214 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -164.89 173.59 11.51 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 131.135 3.774 . . . . 10.0 105.595 173.12 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -57.6 -36.0 71.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 120.442 1.474 . . . . 10.0 114.036 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.97 -54.7 34.35 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.994 1.27 . . . . 10.0 111.165 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.8 p -65.77 -38.94 90.42 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.761 0.825 . . . . 10.0 111.928 -179.347 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.13 -27.61 59.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.497 1.044 . . . . 10.0 113.471 175.14 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 19.1 mtm -63.5 -53.45 51.82 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.154 1.343 . . . . 10.0 109.274 170.426 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -59.44 -45.82 90.49 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.916 0.76 . . . . 10.0 109.582 179.138 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -65.36 -48.35 73.27 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.59 -0.719 . . . . 10.0 112.762 -179.163 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.38 -29.45 67.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 120.849 1.659 . . . . 10.0 112.103 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -80.07 -22.82 41.84 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.727 1.38 . . . . 10.0 114.727 174.848 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.99 84.59 1.43 Allowed Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.218 1.407 . . . . 10.0 114.431 169.038 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.27 -49.03 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.364 2.043 . . . . 10.0 113.364 -165.637 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -71.66 -32.6 68.08 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.618 1.567 . . . . 10.0 111.519 -172.936 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -71.36 -41.84 69.22 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.603 1.161 . . . . 10.0 111.864 168.355 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -64.88 -48.92 72.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.18 0.9 . . . . 10.0 113.231 178.623 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 10.2 pt -128.75 102.39 19.79 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.688 0.795 . . . . 10.0 110.763 173.687 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.19 136.32 40.16 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.513 2.142 . . . . 10.0 110.752 -177.775 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.512 ' HA3' HD21 ' A' ' 52' ' ' ASN . . . 119.3 -32.39 5.09 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.581 1.562 . . . . 10.0 113.255 -178.217 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m -50.44 -24.79 3.32 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 118.784 2.883 . . . . 10.0 118.784 -165.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.404 ' HE3' ' N ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 58.29 -82.69 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 116.914 -1.517 . . . . 10.0 111.602 -162.174 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.2 ttt 31.25 95.47 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.398 2.679 . . . . 10.0 113.893 -169.026 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.7 mt -71.69 45.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 C-N-CA 126.772 2.029 . . . . 10.0 112.759 -175.6 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -163.45 86.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.245 2.218 . . . . 10.0 108.847 178.83 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.23 -13.73 62.3 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.138 1.532 . . . . 10.0 115.138 -170.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.3 165.12 31.52 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.655 1.121 . . . . 10.0 111.84 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.3 tt -95.08 170.36 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.061 1.345 . . . . 10.0 111.968 -178.199 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -45.68 -45.32 14.07 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.616 2.366 . . . . 10.0 114.604 -167.546 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -164.55 177.87 7.79 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.945 2.498 . . . . 10.0 108.661 168.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -64.36 -27.92 69.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.332 1.605 . . . . 10.0 115.332 -171.26 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.33 -49.95 74.48 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.935 1.698 . . . . 10.0 112.025 -179.824 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -76.66 -6.61 52.78 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.195 1.798 . . . . 10.0 114.569 172.236 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER -78.76 -36.1 43.56 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.634 -1.916 . . . . 10.0 112.502 156.591 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -69.16 -42.69 75.58 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.69 -1.256 . . . . 10.0 111.002 174.661 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.503 ' CB ' ' H ' ' A' ' 2' ' ' ASP 0.256 1.0 OUTLIER -60.68 -38.19 84.13 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.909 0.484 . . . . 10.0 112.217 -179.131 . . . . . . . . 4 4 . 1 . 029 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 mp -57.09 -47.84 80.05 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.581 1.952 . . . . 10.0 113.325 166.823 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.89 -49.69 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.306 0.957 . . . . 10.0 109.458 173.663 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.4 -46.48 86.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.129 0.972 . . . . 10.0 112.694 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.74 -61.71 2.39 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.094 1.357 . . . . 10.0 111.696 171.452 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.1 -28.24 69.31 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.355 -0.841 . . . . 10.0 112.897 -171.866 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.15 -16.31 63.86 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 172.044 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -107.38 -24.21 11.92 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 167.773 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.37 60.46 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.068 1.136 . . . . 10.0 114.068 -177.718 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.1 p -86.92 -4.74 59.21 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.085 1.354 . . . . 10.0 113.668 175.627 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -153.45 -7.42 0.17 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 116.264 1.95 . . . . 10.0 116.264 -165.648 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.972 -1.966 . . . . 10.0 114.088 166.549 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.475 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 CA-C-O 118.861 -0.966 . . . . 10.0 111.333 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.29 155.61 49.9 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -150.031 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 89.5 t -55.93 -52.87 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 125.25 1.42 . . . . 10.0 110.553 177.042 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.404 ' HA ' ' CE ' ' A' ' 7' ' ' LYS . 4.2 mp0 -53.38 -53.85 45.13 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.036 1.734 . . . . 10.0 113.691 179.172 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -55.57 -36.43 66.83 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.201 0.6 . . . . 10.0 110.828 173.321 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.53 -53.11 8.91 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.414 -1.074 . . . . 10.0 110.414 -172.088 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.404 ' CE ' ' HA ' ' A' ' 4' ' ' GLU . 31.9 pttt -57.54 -46.21 84.14 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.533 1.166 . . . . 10.0 112.466 -179.766 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -67.98 -46.23 71.93 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.601 0.76 . . . . 10.0 112.586 -178.682 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.1 mm -65.7 -35.55 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 118.733 0.697 . . . . 10.0 111.252 175.134 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -61.22 -53.6 54.81 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.99 0.814 . . . . 10.0 111.293 172.799 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.5 t -62.92 -11.63 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.341 -0.849 . . . . 10.0 112.81 -178.984 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -93.38 -59.27 2.06 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.76 1.624 . . . . 10.0 110.908 174.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -95.75 -12.35 25.53 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.738 1.385 . . . . 10.0 114.738 -168.987 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -123.73 -43.68 2.12 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.932 1.293 . . . . 10.0 111.732 -167.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.52 -7.73 5.11 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 167.093 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -16.44 12.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.766 2.027 . . . . 10.0 113.463 163.305 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.1 m -143.34 -27.48 0.56 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.204 1.802 . . . . 10.0 114.053 179.007 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -107.49 -161.68 0.79 Allowed 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 128.916 2.887 . . . . 10.0 111.309 -178.688 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -151.3 -61.79 0.18 Allowed 'General case' 0 N--CA 1.483 1.2 0 O-C-N 119.639 -1.913 . . . . 10.0 113.765 152.714 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.444 ' HB ' ' H ' ' A' ' 32' ' ' LEU 0.277 5.1 p 51.51 -48.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 130.219 3.408 . . . . 10.0 117.786 -175.477 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.15 128.26 34.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.122 1.328 . . . . 10.0 108.02 168.814 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.5 pttt 45.71 30.64 0.85 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.561 1.544 . . . . 10.0 113.842 -169.033 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.87 -66.88 1.73 Allowed Glycine 0 CA--C 1.528 0.885 0 C-N-CA 126.871 2.177 . . . . 10.0 112.515 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.8 -112.43 4.98 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.673 1.606 . . . . 10.0 113.703 -179.451 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -160.85 -173.78 4.09 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.488 1.515 . . . . 10.0 111.429 -160.885 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -151.77 73.96 1.09 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.078 1.751 . . . . 10.0 110.048 -171.205 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -73.28 -35.14 66.1 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m -152.16 -29.91 0.16 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.961 -168.832 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -118.28 164.53 12.84 Favored Glycine 0 CA--C 1.538 1.517 0 N-CA-C 109.373 -1.491 . . . . 10.0 109.373 157.327 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -70.42 167.25 25.85 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.879 2.386 . . . . 10.0 111.413 -178.691 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -64.89 136.9 57.37 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.027 -1.471 . . . . 10.0 107.027 158.552 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.444 ' H ' ' HB ' ' A' ' 20' ' ' VAL . 2.8 mm? -79.04 66.93 4.61 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.199 -0.938 . . . . 10.0 109.274 -178.713 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.543 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -52.36 91.29 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 129.276 3.03 . . . . 10.0 111.592 -168.928 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 65.45 -70.26 0.1 OUTLIER Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.286 1.422 . . . . 10.0 111.907 -164.425 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.519 HD12 ' NH1' ' A' ' 38' ' ' ARG . 0.7 OUTLIER 65.75 -176.33 0.18 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 127.125 2.17 . . . . 10.0 110.411 -168.574 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 55.83 83.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.476 1.51 . . . . 10.0 113.758 179.277 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.3 -7.05 23.01 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.023 2.725 . . . . 10.0 113.638 -177.436 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.543 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 15.8 ttp180 -86.94 -139.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.099 2.16 . . . . 10.0 114.154 -171.719 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -153.39 162.96 40.75 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.995 2.518 . . . . 10.0 111.073 -177.704 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 55.0 p -67.21 -59.89 3.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.739 1.216 . . . . 10.0 111.38 178.135 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.04 75.11 0.48 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 125.879 1.704 . . . . 10.0 113.835 -178.427 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -0.34 3.88 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.573 1.694 . . . . 10.0 115.573 175.002 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -52.52 134.45 44.12 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.19 1.396 . . . . 10.0 113.356 -176.689 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -82.45 -107.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.749 2.966 . . . . 10.0 111.053 179.549 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.05 48.38 3.02 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.341 -1.474 . . . . 10.0 112.993 178.508 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -151.7 163.56 38.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.375 1.559 . . . . 10.0 111.997 -177.113 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -154.84 111.37 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.664 1.585 . . . . 10.0 107.03 166.773 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -82.17 -43.22 17.99 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.457 1.503 . . . . 10.0 110.658 -176.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.2 p -156.99 -153.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 129.473 3.109 . . . . 10.0 107.773 177.54 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -159.86 -171.01 3.08 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.901 1.68 . . . . 10.0 108.226 157.618 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 64.55 -32.14 0.13 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.188 2.195 . . . . 10.0 113.759 -157.772 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -75.37 -42.69 53.4 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 121.975 2.17 . . . . 10.0 113.694 166.651 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -50.89 -51.22 53.94 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.114 -0.991 . . . . 10.0 111.383 172.294 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -66.13 -16.25 63.8 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.555 1.687 . . . . 10.0 115.555 172.03 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.46 -17.21 59.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.28 1.4 . . . . 10.0 114.224 -179.848 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.82 -44.38 2.05 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.336 -1.813 . . . . 10.0 116.6 170.781 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -31.96 3.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.736 2 C-N-CA 133.915 4.886 . . . . 10.0 122.766 -135.232 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 38.3 m 56.21 104.13 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 128.024 2.53 . . . . 10.0 114.889 -177.29 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -58.31 140.87 52.61 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 113.559 -1.655 . . . . 10.0 110.94 159.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -175.42 -43.29 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.297 1.439 . . . . 10.0 113.763 -165.22 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.253 13.6 pt-20 163.29 -62.36 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 130.0 3.32 . . . . 10.0 111.715 165.558 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -46.22 -45.21 16.82 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.39 1.476 . . . . 10.0 112.538 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.8 p -68.63 -31.43 70.58 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 125.02 1.328 . . . . 10.0 112.535 178.115 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -75.43 -33.25 60.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.114 1.324 . . . . 10.0 112.591 168.991 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.7 mtm -57.31 -53.45 58.02 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.48 1.112 . . . . 10.0 109.235 175.26 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -67.74 -41.4 83.46 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 123.917 0.761 . . . . 10.0 110.622 178.608 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.66 -53.7 25.66 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.787 0.662 . . . . 10.0 112.787 -175.867 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -60.27 -42.79 96.14 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.957 1.253 . . . . 10.0 110.934 179.041 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -72.06 -23.84 61.43 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 114.599 1.333 . . . . 10.0 114.599 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 61.65 1.59 Allowed Pre-proline 0 CA--C 1.564 1.491 0 C-N-CA 125.007 1.323 . . . . 10.0 111.088 -167.294 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.63 -62.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.359 2.706 . . . . 10.0 113.835 -162.106 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -61.58 -26.49 68.0 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.177 1.391 . . . . 10.0 113.613 -178.65 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -71.81 -51.53 22.07 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.015 0.926 . . . . 10.0 110.22 170.854 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -60.76 -47.75 84.9 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.447 0.536 . . . . 10.0 112.447 -177.58 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.85 108.09 9.05 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.319 1.047 . . . . 10.0 109.7 174.947 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.55 153.46 60.28 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 122.03 1.82 . . . . 10.0 110.616 172.704 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.74 46.43 4.56 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-O 118.956 -0.913 . . . . 10.0 111.922 -170.674 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -138.44 -39.03 0.53 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 116.051 1.871 . . . . 10.0 116.051 -165.911 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt 60.27 -65.74 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 -171.279 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.7 ttt 20.46 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 130.059 3.344 . . . . 10.0 113.063 -171.193 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 81' ' ' ILE . 4.0 mp -69.5 74.25 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 126.423 1.889 . . . . 10.0 110.054 -175.432 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -163.51 -40.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.8 1.64 . . . . 10.0 112.605 178.648 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.57 82.6 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.025 2.53 . . . . 10.0 115.253 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.63 -161.37 16.88 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.942 1.258 . . . . 10.0 111.445 -169.217 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.6 tt -143.33 30.37 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.637 1.175 . . . . 10.0 110.435 170.975 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttt 69.35 0.59 2.94 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.459 2.304 . . . . 10.0 113.993 -175.77 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -162.61 173.49 13.86 Favored 'General case' 0 CA--C 1.542 0.649 1 C-N-CA 132.551 4.341 . . . . 10.0 106.979 -176.771 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -77.47 -52.06 9.72 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 155.62 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 m -43.65 -50.62 7.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.377 1.871 . . . . 10.0 113.054 -155.259 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -65.52 -24.47 67.13 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.652 0.781 . . . . 10.0 112.269 -173.347 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.474 HH21 HD12 ' A' ' 95' ' ' ILE 0.373 0.0 OUTLIER -76.18 -13.0 60.19 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.328 0.967 . . . . 10.0 113.441 172.498 . . . . . . . . 4 4 . 1 . 030 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -67.31 -52.64 37.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.857 0.863 . . . . 10.0 109.979 161.179 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -57.61 -44.28 85.34 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.52 1.528 . . . . 10.0 112.828 177.752 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.88 90.13 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.991 0.737 . . . . 10.0 112.991 174.303 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.474 HD12 HH21 ' A' ' 91' ' ' ARG . 14.3 mt -62.18 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 119.035 -0.507 . . . . 10.0 110.538 173.583 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.31 75.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.43 0.692 . . . . 10.0 111.916 175.307 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.2 -57.51 12.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.813 1.645 . . . . 10.0 112.946 173.062 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -66.72 -29.12 69.03 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.657 1.117 . . . . 10.0 113.22 -175.019 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -59.27 -26.95 65.37 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.841 0.856 . . . . 10.0 112.919 168.989 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -85.56 -53.23 5.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 117.821 -1.085 . . . . 10.0 112.009 165.644 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.37 -15.74 39.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.967 1.84 . . . . 10.0 115.967 -171.662 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.3 t -68.46 -2.78 9.42 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.133 1.161 . . . . 10.0 114.133 165.477 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -151.2 -23.6 0.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.225 1.81 . . . . 10.0 114.071 -176.218 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.7 2.0 . . . . 10.0 110.921 179.639 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.434 ' CGA' HH22 ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 CA-C-O 118.735 -1.036 . . . . 10.0 110.708 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -133.76 161.38 34.86 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.256 1.206 . . . . 10.0 114.256 -152.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.7 m -68.35 -41.49 83.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 122.709 0.403 . . . . 10.0 111.977 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 mp0 -60.76 -49.26 78.22 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.843 1.257 . . . . 10.0 110.26 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.442 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 8.8 mmpt? -62.71 -14.77 47.99 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.687 1.195 . . . . 10.0 113.095 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -104.79 -45.34 1.41 Allowed Glycine 0 C--N 1.339 0.704 0 CA-C-N 119.703 1.138 . . . . 10.0 112.46 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -34.69 72.3 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.709 1.754 . . . . 10.0 112.443 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -62.19 -28.67 69.83 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.832 1.253 . . . . 10.0 114.259 177.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -98.42 -32.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.139 0.976 . . . . 10.0 110.684 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.478 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 t80 -57.82 -54.32 48.25 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 121.823 -0.548 . . . . 10.0 110.935 169.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.5 t -66.01 -11.62 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -90.25 -56.04 3.37 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.721 1.208 . . . . 10.0 111.325 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -125.59 7.76 7.6 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 116.238 1.94 . . . . 10.0 116.238 -168.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 33.7 m -110.76 -49.01 3.07 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.295 1.038 . . . . 10.0 110.648 166.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.53 53.07 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.919 1.081 . . . . 10.0 113.919 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -13.77 39.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.827 2.451 . . . . 10.0 113.564 169.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.6 m -141.15 -33.64 0.52 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.229 1.812 . . . . 10.0 112.237 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -120.19 66.6 0.83 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 128.954 2.902 . . . . 10.0 109.922 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -68.19 127.49 33.11 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.356 -1.465 . . . . 10.0 108.178 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.42 -66.39 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 124.632 1.173 . . . . 10.0 110.595 -176.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.53 -31.32 65.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.184 0.902 . . . . 10.0 112.698 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.17 -6.23 59.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.55 1.14 . . . . 10.0 113.785 178.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.177 0 C-N-CA 126.596 2.046 . . . . 10.0 110.871 -163.459 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 N--CA 1.483 1.196 0 N-CA-C 113.398 0.888 . . . . 10.0 113.398 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.66 167.35 24.83 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 157.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.02 127.9 16.8 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.854 2.369 . . . . 10.0 110.805 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.99 127.61 32.19 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.224 -0.923 . . . . 10.0 110.45 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.7 81.5 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.858 1.263 . . . . 10.0 111.862 -170.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.68 73.14 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.111 2.164 . . . . 10.0 109.962 163.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.78 -63.08 0.32 Allowed Glycine 0 CA--C 1.535 1.312 0 C-N-CA 127.718 2.58 . . . . 10.0 114.065 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 68.29 -48.6 0.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.449 2.7 . . . . 10.0 116.022 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.715 ' HB2' HG21 ' A' ' 102' ' ' THR . 41.8 m-85 -63.67 113.44 3.36 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.595 1.089 . . . . 10.0 111.095 -174.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.48 0.0 82.37 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.954 1.264 . . . . 10.0 113.947 -175.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.8 mtp85 -86.89 -127.93 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.901 1.281 . . . . 10.0 110.802 172.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -154.35 173.41 16.23 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.188 1.795 . . . . 10.0 110.99 -172.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 t -95.8 -48.16 5.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.967 0.907 . . . . 10.0 113.344 -174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.05 61.66 2.99 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.528 1.537 . . . . 10.0 111.609 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -130.15 -18.96 3.23 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.088 1.755 . . . . 10.0 113.347 -161.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.32 151.74 86.5 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 124.464 1.105 . . . . 10.0 112.572 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -76.01 -160.19 0.11 Allowed 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 124.277 3.318 . . . . 10.0 110.839 167.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.23 86.96 0.01 OUTLIER Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.715 2.103 . . . . 10.0 115.327 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -144.05 -179.43 6.49 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.329 2.252 . . . . 10.0 109.559 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.6 m -156.86 142.9 17.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 119.741 -1.849 . . . . 10.0 109.774 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.55 -85.72 0.06 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.886 0.874 . . . . 10.0 112.806 -163.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 t -144.93 173.85 11.52 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.639 2.776 . . . . 10.0 108.751 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.05 -37.33 58.42 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.953 -1.092 . . . . 10.0 112.322 155.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.1 -61.82 1.99 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.022 1.329 . . . . 10.0 112.776 -160.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -51.71 -61.82 2.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.963 0.905 . . . . 10.0 111.906 -171.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -56.08 26.79 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.418 1.087 . . . . 10.0 111.847 -176.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -44.2 82.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.176 -0.916 . . . . 10.0 111.737 -171.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.59 -45.25 38.7 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.171 -0.919 . . . . 10.0 111.708 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 55.37 -179.24 0.33 Allowed Glycine 0 CA--C 1.54 1.621 0 N-CA-C 116.696 1.438 . . . . 10.0 116.696 -176.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.66 -6.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 128.328 2.651 . . . . 10.0 113.701 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.0 m 55.84 115.95 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.846 2.059 . . . . 10.0 113.038 -159.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -73.09 126.3 29.67 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.295 -0.878 . . . . 10.0 111.658 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -165.34 176.03 8.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.272 2.229 . . . . 10.0 110.184 -174.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.32 -30.06 64.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.248 1.419 . . . . 10.0 114.33 -176.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -71.96 -71.65 0.27 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.853 0.861 . . . . 10.0 110.746 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.5 p -59.61 -38.15 80.49 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 125.88 1.672 . . . . 10.0 112.844 -165.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.28 -29.44 60.11 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.289 0.949 . . . . 10.0 113.134 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 ttm -69.6 -48.75 59.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 171.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -57.29 -45.0 84.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.275 1.43 . . . . 10.0 110.546 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.415 ' HE1' HG21 ' A' ' 78' ' ' THR . 73.1 t80 -61.48 -60.04 4.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.619 1.568 . . . . 10.0 112.945 172.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -56.63 -32.23 65.12 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.783 1.629 . . . . 10.0 114.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.21 -24.61 63.13 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.909 1.448 . . . . 10.0 114.909 174.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -163.3 91.71 1.17 Allowed Pre-proline 0 CA--C 1.552 1.035 0 CA-C-N 119.759 1.163 . . . . 10.0 112.602 162.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.98 -37.99 2.48 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.406 2.071 . . . . 10.0 112.544 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -59.06 -43.12 91.69 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.878 1.671 . . . . 10.0 112.444 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -75.0 -41.06 60.24 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 118.982 -0.532 . . . . 10.0 111.434 175.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -69.04 -36.72 78.03 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.821 1.415 . . . . 10.0 114.821 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -131.18 127.82 21.99 Favored Pre-proline 0 N--CA 1.475 0.788 0 CA-C-N 119.169 0.895 . . . . 10.0 111.035 172.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.15 93.8 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.912 3.075 . . . . 10.0 113.315 -153.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 110.97 0.0 28.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.574 1.083 . . . . 10.0 114.299 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.415 HG21 ' HE1' ' A' ' 67' ' ' TYR . 12.5 m -60.15 106.58 0.53 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.68 1.24 . . . . 10.0 111.206 172.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -64.36 -56.67 12.8 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.211 -0.9 . . . . 10.0 112.157 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.0 ttt 25.31 84.2 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.814 2.445 . . . . 10.0 114.115 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 30.8 mt -73.57 77.33 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.937 1.295 . . . . 10.0 110.829 -172.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -163.34 -45.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.15 1.78 . . . . 10.0 111.62 170.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.58 0.96 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 120.743 3.608 . . . . 10.0 120.743 172.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.72 170.71 40.65 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 125.516 1.531 . . . . 10.0 111.176 169.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -143.18 63.12 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 118.809 1.305 . . . . 10.0 112.861 -164.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 62.29 -56.87 0.14 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 128.22 2.608 . . . . 10.0 116.096 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -163.47 156.25 18.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.6 2.36 . . . . 10.0 109.096 -169.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -7.7 11.79 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 10.0 115.301 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -54.1 8.8 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.446 1.499 . . . . 10.0 110.751 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -54.28 -35.3 62.42 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.306 1.042 . . . . 10.0 110.95 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -56.8 -65.19 0.66 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.583 1.953 . . . . 10.0 112.107 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -31.56 72.47 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.997 0.74 . . . . 10.0 112.997 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -57.55 -47.42 82.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.692 0.797 . . . . 10.0 110.61 170.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.82 -46.43 84.7 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 175.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.1 mm -56.48 -52.53 51.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.82 60.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 117.64 -1.171 . . . . 10.0 113.669 -174.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.4 -64.87 0.76 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.374 1.869 . . . . 10.0 110.805 162.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.6 mt -60.17 -30.28 69.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.278 0.631 . . . . 10.0 112.684 -174.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -59.3 -21.93 60.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.872 1.064 . . . . 10.0 113.872 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -79.27 -45.19 20.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.694 -1.146 . . . . 10.0 110.809 168.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.19 1.28 0.19 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.304 1.594 . . . . 10.0 115.304 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.715 HG21 ' HB2' ' A' ' 36' ' ' PHE . 9.6 p -110.37 11.84 23.21 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.859 1.663 . . . . 10.0 114.348 168.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -153.57 -34.59 0.11 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.534 1.061 . . . . 10.0 113.815 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 . . . . . 0 C--O 1.259 1.563 0 C-N-CA 125.161 1.385 . . . . 10.0 110.9 149.669 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.896 0 CA-C-O 118.416 -1.213 . . . . 10.0 111.007 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -109.21 145.51 35.74 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.905 0.852 . . . . 10.0 112.467 -167.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.12 -41.43 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 118.413 -0.803 . . . . 10.0 112.005 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -51.79 -57.03 10.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.911 1.284 . . . . 10.0 112.611 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -57.06 -25.5 58.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.006 1.323 . . . . 10.0 111.722 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -86.94 -50.37 3.73 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.406 1.479 . . . . 10.0 111.841 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.5 pttp -63.13 -43.21 99.01 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.76 1.28 . . . . 10.0 111.57 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -40.83 97.7 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.054 -0.974 . . . . 10.0 111.728 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.85 -25.29 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 119.384 0.993 . . . . 10.0 112.774 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -55.96 -50.75 69.94 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.249 -0.907 . . . . 10.0 109.681 163.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.04 29.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 N-CA-C 113.415 0.894 . . . . 10.0 113.415 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -36.57 5.36 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 119.265 -2.147 . . . . 10.0 112.272 164.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.99 -55.59 1.37 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.631 0.772 . . . . 10.0 112.921 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -52.15 -49.49 63.66 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 125.256 1.422 . . . . 10.0 112.802 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.7 -22.87 62.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.925 1.083 . . . . 10.0 113.925 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -16.16 51.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.92 0.888 . . . . 10.0 112.356 173.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 82.1 m -141.34 0.51 1.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.864 1.266 . . . . 10.0 114.228 -174.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 97.1 m-70 -150.47 12.17 0.71 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.593 1.331 . . . . 10.0 114.593 -172.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 t -42.76 104.9 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.7 1.741 . . . . 10.0 115.7 -165.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.8 p -142.29 -8.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 127.339 2.256 . . . . 10.0 112.559 -171.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.73 -18.82 13.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.124 1.369 . . . . 10.0 112.033 165.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -152.76 145.98 24.72 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.395 1.478 . . . . 10.0 110.981 155.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.446 0 C-N-CA 125.354 1.454 . . . . 10.0 115.559 176.8 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 116.676 2.102 . . . . 10.0 116.676 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.57 168.86 14.98 Favored Glycine 0 CA--C 1.543 1.807 0 CA-C-N 120.582 1.537 . . . . 10.0 112.918 171.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 20.9 Cg_endo -71.55 -8.09 22.54 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 124.691 3.594 . . . . 10.0 118.61 -167.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.57 142.16 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.741 1.616 . . . . 10.0 113.87 -154.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -85.51 70.39 10.76 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.052 -1.03 . . . . 10.0 110.157 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.27 114.53 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.316 1.446 . . . . 10.0 110.17 165.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 9.14 76.36 0.01 OUTLIER Glycine 0 N--CA 1.476 1.308 0 C-N-CA 129.044 3.212 . . . . 10.0 115.9 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -30.6 65.3 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 116.189 1.922 . . . . 10.0 116.189 -156.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -85.87 93.67 8.97 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.965 0.802 . . . . 10.0 111.607 -159.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.08 -13.91 6.31 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 127.051 2.262 . . . . 10.0 114.282 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -85.81 157.98 20.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.733 1.266 . . . . 10.0 113.416 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -77.01 169.76 17.75 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.659 1.184 . . . . 10.0 112.023 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.2 t -50.91 155.54 1.17 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.065 2.146 . . . . 10.0 115.927 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 59.11 31.06 68.11 Favored Glycine 0 CA--C 1.539 1.546 0 N-CA-C 118.458 2.143 . . . . 10.0 118.458 155.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -83.59 7.0 18.62 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 120.241 2.021 . . . . 10.0 115.363 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 133.91 93.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.623 1.102 . . . . 10.0 112.72 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.12 87.38 0.73 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.646 2.23 . . . . 10.0 113.041 -172.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.13 -1.7 88.5 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.947 1.736 . . . . 10.0 115.823 167.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -66.39 137.08 56.62 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.754 1.277 . . . . 10.0 112.067 176.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 m -72.61 83.08 1.13 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.716 1.607 . . . . 10.0 112.652 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.28 175.33 9.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.639 1.176 . . . . 10.0 112.917 168.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.1 p -76.68 -175.36 3.36 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.695 1.598 . . . . 10.0 113.572 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -66.79 177.09 1.75 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.208 1.403 . . . . 10.0 113.23 152.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.67 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 129.352 3.061 . . . . 10.0 116.029 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -47.61 -59.93 2.91 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.891 1.678 . . . . 10.0 112.286 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -27.0 68.97 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.545 -0.722 . . . . 10.0 112.482 -176.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -26.8 63.86 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 117.209 2.3 . . . . 10.0 117.209 171.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -163.29 -1.31 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 116.648 2.092 . . . . 10.0 116.648 -155.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -67.85 163.34 47.47 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.63 1.586 . . . . 10.0 114.107 -177.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -66.31 173.89 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.89 2.476 . . . . 10.0 114.206 -176.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 m -69.57 124.33 23.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.024 0.93 . . . . 10.0 110.232 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -75.38 124.64 27.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.578 0.751 . . . . 10.0 111.716 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.8 pttt -171.3 -176.73 1.95 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.562 2.345 . . . . 10.0 109.5 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.33 -55.07 5.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.901 0.88 . . . . 10.0 112.299 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.21 12.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.948 2.499 . . . . 10.0 115.783 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 63.5 p -157.67 -34.8 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.246 1.018 . . . . 10.0 111.356 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -33.27 60.69 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.807 1.185 . . . . 10.0 112.761 169.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 70.3 mtm -66.28 -48.15 71.35 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.979 1.263 . . . . 10.0 110.521 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -63.89 -37.79 88.71 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 122.652 0.381 . . . . 10.0 110.397 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -65.01 -60.63 2.83 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-O 119.035 -0.507 . . . . 10.0 111.927 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -29.92 70.31 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 120.196 1.362 . . . . 10.0 112.444 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -69.08 -31.24 69.84 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 170.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.84 76.79 1.67 Allowed Pre-proline 0 CA--C 1.553 1.078 0 CA-C-N 120.035 1.289 . . . . 10.0 113.163 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.01 -44.23 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.928 1.752 . . . . 10.0 111.942 -159.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -68.03 -30.65 69.93 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 126.427 1.891 . . . . 10.0 112.7 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -76.26 -40.24 52.36 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.737 1.215 . . . . 10.0 112.352 168.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -63.97 -45.88 87.1 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.748 0.704 . . . . 10.0 112.45 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.99 129.39 10.52 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.796 1.638 . . . . 10.0 110.414 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.62 179.42 4.7 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.806 2.337 . . . . 10.0 112.656 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.2 -33.87 1.1 Allowed Glycine 0 CA--C 1.529 0.943 0 C-N-CA 126.216 1.865 . . . . 10.0 114.156 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 90.3 m -60.56 83.26 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.997 1.719 . . . . 10.0 113.957 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.22 31.96 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.477 2.711 . . . . 10.0 114.123 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.7 ttt -64.39 108.78 1.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.058 1.743 . . . . 10.0 111.219 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 mt -76.5 67.33 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.856 1.262 . . . . 10.0 110.481 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -163.43 -35.9 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.693 1.368 . . . . 10.0 114.693 172.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.22 -3.96 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 121.154 3.761 . . . . 10.0 121.154 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.83 -147.72 5.08 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-N 120.868 1.667 . . . . 10.0 112.148 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tt -144.48 171.86 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.937 0.895 . . . . 10.0 108.89 158.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -75.01 -7.31 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.618 1.34 . . . . 10.0 114.618 -160.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.59 -67.37 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.882 1.273 . . . . 10.0 110.666 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.38 -53.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 127.577 2.351 . . . . 10.0 112.634 162.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.7 m -50.92 -33.62 25.07 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.357 1.863 . . . . 10.0 112.118 -168.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -45.15 -50.09 11.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.254 1.422 . . . . 10.0 112.202 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.353 0.0 OUTLIER -77.76 -10.84 59.75 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.112 1.523 . . . . 10.0 115.112 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -75.02 -40.72 60.36 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.163 0.892 . . . . 10.0 110.488 162.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.22 -40.28 78.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.417 1.087 . . . . 10.0 112.092 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 15.9 tp -57.84 -46.23 85.08 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.579 1.552 . . . . 10.0 113.122 178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 mm -59.07 -46.42 91.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 C-N-CA 124.176 0.99 . . . . 10.0 109.786 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -43.36 98.75 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.146 0.43 . . . . 10.0 111.931 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.6 -56.64 19.6 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.824 0.85 . . . . 10.0 111.974 170.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.15 -26.55 68.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.778 1.172 . . . . 10.0 112.955 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.01 -12.2 7.54 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.402 1.481 . . . . 10.0 113.382 167.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -131.62 36.04 3.77 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.206 3.002 . . . . 10.0 111.979 166.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.72 30.69 4.34 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.4 1.48 . . . . 10.0 110.052 154.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -142.36 7.73 1.76 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.895 2.078 . . . . 10.0 115.112 -174.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -153.05 -73.24 0.14 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.454 2.302 . . . . 10.0 108.242 177.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.258 1.529 0 CA-C-O 117.133 -1.413 . . . . 10.0 109.083 124.222 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.96 0 CA-C-O 119.112 -0.826 . . . . 10.0 111.407 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.401 ' HB3' ' H ' ' A' ' 4' ' ' GLU . 57.8 m-20 -93.99 -173.16 3.04 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.399 1.88 . . . . 10.0 110.853 176.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.0 t -78.78 -32.9 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 120.312 -1.492 . . . . 10.0 111.166 143.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.401 ' H ' ' HB3' ' A' ' 2' ' ' ASP . 0.6 OUTLIER -68.15 -36.08 79.1 Favored 'General case' 0 CA--C 1.514 -0.425 0 C-N-CA 128.063 2.545 . . . . 10.0 114.224 -159.653 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -73.36 -25.47 60.61 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.44 -54.5 5.51 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 126.167 1.842 . . . . 10.0 110.289 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -23.39 67.4 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.485 1.291 . . . . 10.0 114.485 178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -76.49 -53.49 8.03 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 120.143 1.338 . . . . 10.0 113.414 164.283 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.32 -31.33 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.438 1.017 . . . . 10.0 112.555 -170.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.56 -51.31 69.06 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.175 0.443 . . . . 10.0 109.999 172.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.2 -9.1 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 112.868 0.692 . . . . 10.0 112.868 -177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -96.11 -47.68 5.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.374 1.47 . . . . 10.0 111.562 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -119.62 -8.53 9.94 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.428 1.64 . . . . 10.0 115.428 -170.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 34.5 m -113.92 -45.16 3.1 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.813 1.245 . . . . 10.0 111.325 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.21 -25.04 61.13 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 176.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.05 -14.39 0.41 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.415 2.686 . . . . 10.0 114.096 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -141.23 -34.7 0.48 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.609 1.564 . . . . 10.0 112.053 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -103.58 -9.68 19.05 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.949 1.463 . . . . 10.0 114.949 -173.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' H ' ' A' ' 20' ' ' VAL 0.359 6.8 t 38.58 -88.93 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.305 2.642 . . . . 10.0 115.694 -166.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 19' ' ' THR 0.3 8.7 p 37.48 48.51 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 128.965 2.906 . . . . 10.0 115.986 174.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.44 -41.11 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.274 1.03 . . . . 10.0 112.784 170.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -154.14 -40.99 0.09 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 130.431 3.492 . . . . 10.0 110.786 -173.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.128 0 C-N-CA 127.064 2.269 . . . . 10.0 112.302 177.935 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.9 m . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -133.72 163.82 24.42 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.564 2.031 . . . . 10.0 111.754 162.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.72 161.56 21.6 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.261 2.641 . . . . 10.0 112.075 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.546 HD21 ' CD2' ' A' ' 33' ' ' HIS . 8.9 p-10 -65.29 11.25 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 130.267 3.427 . . . . 10.0 115.944 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt 50.52 -33.25 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.952 1 C-N-CA 132.075 4.15 . . . . 10.0 118.181 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.546 ' CD2' HD21 ' A' ' 31' ' ' ASN 0.276 0.0 OUTLIER 34.5 72.58 0.09 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.631 3.172 . . . . 10.0 114.227 178.789 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.92 -34.49 0.74 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 126.288 1.899 . . . . 10.0 114.667 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tp 60.51 -68.08 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.814 3.246 . . . . 10.0 116.387 170.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -65.67 114.51 5.03 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.645 1.578 . . . . 10.0 110.82 -171.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.68 1.83 88.94 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 118.654 -1.081 . . . . 10.0 114.484 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.573 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.6 OUTLIER -78.81 -96.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.887 1.343 . . . . 10.0 108.469 169.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -156.64 175.18 14.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.752 2.421 . . . . 10.0 109.781 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.7 m -109.09 95.37 5.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.871 -1.9 . . . . 10.0 105.871 153.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.27 -66.3 0.09 OUTLIER Glycine 0 CA--C 1.528 0.858 0 CA-C-O 122.022 0.79 . . . . 10.0 113.069 -163.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -64.77 133.91 53.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.679 1.992 . . . . 10.0 113.514 -172.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.66 150.76 10.48 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 128.47 2.708 . . . . 10.0 107.317 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.57 66.27 8.55 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.734 2.956 . . . . 10.0 111.817 -176.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.86 71.59 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.295 0.95 . . . . 10.0 115.219 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.11 119.59 10.46 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.08 1.352 . . . . 10.0 111.204 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.0 m -70.92 82.98 0.66 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.291 1.837 . . . . 10.0 113.174 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -86.17 -173.25 4.47 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.795 1.638 . . . . 10.0 113.896 170.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.3 t -62.57 172.49 1.57 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 126.188 1.795 . . . . 10.0 111.581 168.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -75.47 -80.44 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 120.417 -1.427 . . . . 10.0 111.511 154.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 69.42 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 131.365 3.866 . . . . 10.0 116.498 -165.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -161.68 -70.89 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.363 2.265 . . . . 10.0 107.601 169.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.544 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -55.16 -37.44 66.99 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.11 2.564 . . . . 10.0 111.197 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.74 -37.6 84.82 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.54 1.136 . . . . 10.0 113.192 176.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -76.91 -50.09 14.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.076 0.853 . . . . 10.0 112.011 170.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.34 82.16 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.896 1.236 . . . . 10.0 113.394 -175.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.5 pp -66.23 -16.95 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.067 -1.255 . . . . 10.0 113.618 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.507 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 24.3 m 55.77 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 129.378 3.071 . . . . 10.0 113.393 -169.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.2 m95 -77.18 146.78 36.84 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 120.887 -1.133 . . . . 10.0 111.421 168.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 58' ' ' THR . 7.2 ptpt -163.64 -51.46 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.351 1.46 . . . . 10.0 110.939 -170.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 171.87 -55.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 130.338 3.455 . . . . 10.0 109.44 164.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -44.72 -54.9 5.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.148 2.179 . . . . 10.0 112.48 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 66.9 p -65.52 -28.25 69.04 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 125.213 1.405 . . . . 10.0 113.209 -173.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.507 HD22 HH12 ' A' ' 91' ' ' ARG . 0.3 OUTLIER -75.21 -28.5 59.99 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.375 1.07 . . . . 10.0 112.337 173.423 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.4 mtm -69.88 -47.5 62.37 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-O 118.738 -0.649 . . . . 10.0 110.793 172.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -61.83 -43.2 99.33 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.153 0.502 . . . . 10.0 110.438 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.482 ' HE1' HG21 ' A' ' 78' ' ' THR . 43.0 t80 -57.97 -67.41 0.34 Allowed 'General case' 0 C--O 1.221 -0.441 0 CA-C-O 117.553 -1.213 . . . . 10.0 111.924 176.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.483 ' HB2' HH11 ' A' ' 91' ' ' ARG . 5.4 mt -65.87 -19.55 65.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 121.439 1.927 . . . . 10.0 114.816 -173.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -73.75 -24.7 59.91 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.813 1.188 . . . . 10.0 113.881 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.78 64.84 1.55 Allowed Pre-proline 0 CA--C 1.559 1.311 0 CA-C-N 120.124 1.329 . . . . 10.0 112.999 -177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -72.32 -46.58 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.183 1.922 . . . . 10.0 113.014 -159.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -26.47 68.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.552 1.141 . . . . 10.0 112.697 176.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -76.16 -48.07 21.87 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.728 0.811 . . . . 10.0 111.291 169.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.65 -38.1 88.38 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.561 0.948 . . . . 10.0 113.561 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 pt -142.81 105.58 5.33 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.819 1.248 . . . . 10.0 109.644 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.16 -24.58 44.29 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.484 2.789 . . . . 10.0 115.321 -155.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.33 -9.53 81.7 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.586 -1.119 . . . . 10.0 114.385 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.482 HG21 ' HE1' ' A' ' 67' ' ' TYR . 86.1 m -76.88 75.75 3.48 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.916 1.858 . . . . 10.0 112.442 -172.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -68.97 27.11 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.714 2.006 . . . . 10.0 114.609 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.8 ttp -50.67 117.68 2.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.31 2.244 . . . . 10.0 111.83 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.0 mt -76.48 68.3 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.511 1.524 . . . . 10.0 109.638 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -163.85 -32.28 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.466 1.506 . . . . 10.0 113.533 174.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.7 -24.06 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 120.145 3.387 . . . . 10.0 120.145 -173.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 173.02 167.2 32.6 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 122.131 2.242 . . . . 10.0 113.844 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 tt -93.32 160.71 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.868 0.867 . . . . 10.0 111.909 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.07 -31.49 65.26 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 116.024 1.861 . . . . 10.0 116.024 -167.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -164.34 148.61 9.68 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.724 1.61 . . . . 10.0 109.766 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -20.62 65.28 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.326 1.232 . . . . 10.0 114.326 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.0 m -59.26 -44.25 92.42 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.08 -1.013 . . . . 10.0 111.254 171.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.03 -35.83 82.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.297 1.439 . . . . 10.0 111.045 177.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.507 HH12 HD22 ' A' ' 64' ' ' LEU . 8.1 tpm_? -60.08 -47.94 83.78 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.316 1.446 . . . . 10.0 111.239 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -59.31 -51.32 70.43 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.626 0.77 . . . . 10.0 111.485 170.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -43.71 81.39 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.826 1.65 . . . . 10.0 112.683 -174.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.6 -37.88 73.97 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.35 -48.75 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 118.639 0.654 . . . . 10.0 109.441 173.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.04 -49.78 76.58 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.369 0.668 . . . . 10.0 112.038 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.05 -59.16 5.14 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.091 0.956 . . . . 10.0 111.91 172.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.45 -35.62 79.86 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.406 1.003 . . . . 10.0 112.201 -176.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.74 -15.93 63.3 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.462 1.028 . . . . 10.0 112.976 177.129 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -109.84 20.56 17.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.059 1.343 . . . . 10.0 114.248 165.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.56 -1.18 14.15 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.596 1.558 . . . . 10.0 112.561 164.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.47 -4.36 57.33 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.798 -1.189 . . . . 10.0 113.053 173.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -154.9 3.34 0.21 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.104 1.362 . . . . 10.0 113.973 -159.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 127.755 2.422 . . . . 10.0 107.809 -173.232 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 110.623 -0.991 . . . . 10.0 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -136.76 135.94 38.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.537 1.535 . . . . 10.0 109.198 -161.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.9 t -54.33 -49.95 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.94 0.896 . . . . 10.0 111.08 -172.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.96 -56.31 19.0 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.674 1.59 . . . . 10.0 112.976 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.403 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 32.5 mtmm -61.01 -24.87 66.49 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 112.875 0.695 . . . . 10.0 112.875 175.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.48 -50.58 6.53 Favored Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.042 -1.223 . . . . 10.0 110.042 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -63.32 -43.16 98.59 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 118.911 1.355 . . . . 10.0 113.274 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -62.36 -39.21 92.39 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.134 0.879 . . . . 10.0 112.75 179.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -79.29 -36.07 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.792 0.724 . . . . 10.0 111.719 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -56.21 -48.85 75.63 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.997 0.919 . . . . 10.0 110.683 171.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.61 -15.58 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 113.609 0.966 . . . . 10.0 113.609 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -96.08 -33.72 11.99 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 123.946 0.898 . . . . 10.0 113.42 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.9 1.84 2.8 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 116.109 1.892 . . . . 10.0 116.109 -172.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -122.12 -49.2 2.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.013 1.725 . . . . 10.0 110.851 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.72 66.71 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.545 0.943 . . . . 10.0 113.545 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -46.07 -47.92 17.05 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.911 1.684 . . . . 10.0 112.057 171.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 98.5 m -89.22 -44.39 10.31 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 10.0 113.408 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 88.9 m-70 -105.96 -10.02 16.8 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.607 2.077 . . . . 10.0 116.607 -162.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.308 11.1 t 37.42 -82.17 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 127.699 2.4 . . . . 10.0 116.732 -164.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.267 7.5 p 46.25 -51.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 131.35 3.86 . . . . 10.0 116.055 -161.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -20.11 0.1 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 131.487 3.915 . . . . 10.0 117.642 -168.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.4 pttm -152.49 22.57 0.62 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.844 1.658 . . . . 10.0 111.546 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.163 0 CA-C-O 121.891 0.717 . . . . 10.0 111.862 -165.479 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 m . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 115.46 1.652 . . . . 10.0 115.46 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.03 136.3 12.92 Favored Glycine 0 CA--C 1.542 1.769 0 CA-C-N 120.748 1.613 . . . . 10.0 111.65 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 9.6 Cg_endo -59.66 1.57 0.39 Allowed 'Trans proline' 0 C--N 1.353 0.787 1 C-N-CA 127.2 5.266 . . . . 10.0 118.411 -173.218 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER 63.11 143.02 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.916 2.486 . . . . 10.0 114.12 -161.119 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.29 65.41 9.19 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.287 1.042 . . . . 10.0 110.913 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.81 163.58 1.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.048 1.339 . . . . 10.0 111.446 158.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.8 85.87 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.933 1.73 . . . . 10.0 116.267 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.18 -168.14 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.222 2.609 . . . . 10.0 113.215 169.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 55.02 35.28 24.33 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.819 2.448 . . . . 10.0 114.622 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 166.84 -19.64 0.09 OUTLIER Glycine 0 CA--C 1.531 1.075 0 N-CA-C 115.271 0.869 . . . . 10.0 115.271 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.422 ' HE ' ' HB2' ' A' ' 42' ' ' GLN . 4.2 ptm180 -74.58 -145.23 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.909 1.284 . . . . 10.0 110.994 164.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -151.85 -179.74 7.73 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.636 1.974 . . . . 10.0 109.072 171.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.2 p -59.8 158.32 10.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.448 1.118 . . . . 10.0 112.971 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.0 -8.24 78.75 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 116.96 1.544 . . . . 10.0 116.96 163.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.422 ' HB2' ' HE ' ' A' ' 38' ' ' ARG . 28.1 mm100 -71.13 -7.12 44.4 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.396 1.998 . . . . 10.0 116.396 -167.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.45 134.87 96.13 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.445 1.475 . . . . 10.0 111.275 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -76.77 155.67 34.97 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.014 1.809 . . . . 10.0 111.774 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 21.99 68.01 0.02 OUTLIER Glycine 0 CA--C 1.536 1.363 0 C-N-CA 128.765 3.079 . . . . 10.0 116.67 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -147.62 -42.58 0.17 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.673 0.99 . . . . 10.0 113.673 -172.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 m 60.02 83.76 0.13 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.159 2.184 . . . . 10.0 114.049 170.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -115.46 115.5 26.64 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 126.063 1.745 . . . . 10.0 112.86 -172.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.5 t 50.18 175.87 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.187 2.195 . . . . 10.0 115.119 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -78.49 -69.66 0.55 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.0 1.72 . . . . 10.0 112.316 161.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.36 -30.31 68.29 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.668 1.587 . . . . 10.0 114.21 -157.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.98 -63.42 1.16 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 119.008 0.822 . . . . 10.0 110.668 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -52.13 -43.16 63.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 119.082 -0.485 . . . . 10.0 110.432 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.67 -32.04 73.38 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.622 2.082 . . . . 10.0 116.622 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -54.43 -35.34 62.85 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.816 1.644 . . . . 10.0 113.673 -170.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.26 -9.49 47.67 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.56 1.552 . . . . 10.0 115.646 168.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.8 pp -63.0 159.93 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 126.336 1.854 . . . . 10.0 112.619 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -9.6 58.5 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.415 1.486 . . . . 10.0 114.936 -169.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.5 m95 45.28 97.42 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.556 2.742 . . . . 10.0 114.012 -162.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -161.59 -178.83 6.84 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.168 1.387 . . . . 10.0 109.917 -169.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -61.21 -29.62 69.93 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.667 1.729 . . . . 10.0 115.667 -155.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.49 -51.15 31.01 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 122.299 2.318 . . . . 10.0 111.484 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.4 p -72.32 -40.53 67.4 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.274 1.429 . . . . 10.0 113.153 -174.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.26 -30.24 64.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.977 0.911 . . . . 10.0 111.88 174.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 36.8 ttm -67.81 -48.7 65.5 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.493 -0.765 . . . . 10.0 109.565 169.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -54.3 -44.75 72.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.876 0.762 . . . . 10.0 110.916 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -69.39 -55.95 8.87 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.401 -0.809 . . . . 10.0 112.659 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.51 -11.03 60.49 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.814 1.643 . . . . 10.0 114.379 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -84.72 -29.46 25.53 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 120.507 1.503 . . . . 10.0 112.854 163.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.5 75.61 1.81 Allowed Pre-proline 0 CA--C 1.558 1.267 0 CA-C-N 119.106 0.866 . . . . 10.0 113.002 -172.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -71.3 -56.77 0.11 Allowed 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.486 2.124 . . . . 10.0 112.824 -163.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -65.02 -17.54 64.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.028 1.331 . . . . 10.0 113.905 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -76.34 -49.5 16.7 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.265 1.426 . . . . 10.0 111.586 165.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -62.93 -34.35 77.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.421 0.897 . . . . 10.0 113.421 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.84 125.45 7.46 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.393 1.477 . . . . 10.0 110.66 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.85 169.01 21.34 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.636 2.224 . . . . 10.0 112.657 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.31 -104.46 1.28 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.458 -1.457 . . . . 10.0 109.458 -166.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.4 m 59.93 -39.67 0.09 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 129.217 3.007 . . . . 10.0 118.364 165.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 59.97 -57.59 0.07 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 128.237 2.615 . . . . 10.0 116.311 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt -3.7 87.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 129.824 3.25 . . . . 10.0 113.772 -168.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.9 mp -77.23 70.4 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.82 1.648 . . . . 10.0 109.884 -166.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -163.01 -27.08 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.852 1.661 . . . . 10.0 113.02 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.86 -12.57 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 121.136 3.754 . . . . 10.0 121.136 172.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.34 -142.73 3.46 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 120.688 1.585 . . . . 10.0 111.808 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -144.71 165.12 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.805 0.842 . . . . 10.0 109.912 159.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -67.82 -21.33 65.22 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.852 1.797 . . . . 10.0 115.852 -167.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -163.07 140.68 7.84 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.416 1.486 . . . . 10.0 109.703 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -54.94 -41.79 71.49 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 -159.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -46.08 64.1 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.144 0.977 . . . . 10.0 111.159 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -58.03 -25.8 61.62 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.033 0.933 . . . . 10.0 112.305 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -29.05 59.85 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.853 0.861 . . . . 10.0 113.317 174.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -72.17 -47.19 52.66 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.592 1.157 . . . . 10.0 110.24 169.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.35 -39.41 79.44 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.647 1.179 . . . . 10.0 112.332 174.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.56 -48.45 79.31 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 168.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.7 mm -60.43 -45.14 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.078 0.854 . . . . 10.0 109.823 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.74 80.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.097 0.559 . . . . 10.0 112.453 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.7 -60.38 3.93 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.208 1.003 . . . . 10.0 112.075 174.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.27 -24.52 65.79 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -171.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -57.72 -55.02 40.25 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.884 0.765 . . . . 10.0 111.208 165.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -67.28 -33.19 74.78 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 117.853 -1.07 . . . . 10.0 113.505 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.12 -12.36 2.14 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.619 1.341 . . . . 10.0 114.619 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 p -76.63 -11.16 59.81 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.191 1.397 . . . . 10.0 114.209 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.26 9.45 0.42 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.048 1.339 . . . . 10.0 114.559 -168.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.973 2.909 . . . . 10.0 109.138 -174.054 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.427 0 CA-C-O 119.324 -0.709 . . . . 10.0 112.753 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.424 ' H ' ' HA ' ' A' ' 93' ' ' ASP . 1.0 OUTLIER -123.39 105.26 9.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 117.893 0.846 . . . . 10.0 109.671 -155.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.9 t -46.4 -48.98 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.57 1.548 . . . . 10.0 111.819 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -66.21 -34.7 78.62 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.096 1.358 . . . . 10.0 113.207 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -73.21 -31.64 64.29 Favored 'General case' 0 C--O 1.23 0.063 0 C-N-CA 123.803 0.841 . . . . 10.0 111.754 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.54 -42.14 56.06 Favored Glycine 0 C--O 1.226 -0.349 0 N-CA-C 109.588 -1.405 . . . . 10.0 109.588 -171.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -55.67 -48.16 75.51 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 171.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.65 66.83 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.685 0.994 . . . . 10.0 113.685 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.77 -40.18 76.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 119.658 1.117 . . . . 10.0 110.837 169.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.2 -55.17 30.54 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.709 0.686 . . . . 10.0 109.94 175.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.54 -8.83 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -96.63 -47.57 5.86 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.194 1.398 . . . . 10.0 111.567 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -117.58 -8.33 10.96 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.067 1.506 . . . . 10.0 115.067 -168.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -115.98 -44.56 2.91 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.582 1.553 . . . . 10.0 110.93 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.24 -8.07 5.18 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.81 1.041 . . . . 10.0 113.81 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.57 -15.51 58.27 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.477 1.511 . . . . 10.0 113.057 166.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -143.92 -44.87 0.27 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.934 1.694 . . . . 10.0 113.037 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -85.72 -164.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.768 2.027 . . . . 10.0 110.593 171.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 20' ' ' VAL . 1.4 t -150.19 -77.06 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.528 1.131 . . . . 10.0 111.153 168.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.505 ' H ' HG23 ' A' ' 19' ' ' THR 0.268 0.9 OUTLIER 49.75 -18.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 129.699 3.2 . . . . 10.0 117.204 -171.812 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -68.42 51.21 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 129.336 3.054 . . . . 10.0 113.315 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 mttm 57.71 -21.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 129.466 3.106 . . . . 10.0 117.013 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.176 0 C-N-CA 126.501 2.0 . . . . 10.0 112.637 175.804 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.723 -0.656 . . . . 10.0 111.884 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.06 150.85 17.27 Favored Glycine 0 CA--C 1.546 2.02 0 C-N-CA 124.666 1.127 . . . . 10.0 111.689 161.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -78.4 38.98 0.73 Allowed 'Trans proline' 0 CA--C 1.542 0.911 1 C-N-CA 125.354 4.036 . . . . 10.0 116.634 -163.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 56.42 -163.37 0.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.646 -1.284 . . . . 10.0 110.22 -161.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.56 27.44 1.53 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.28 1.832 . . . . 10.0 111.577 172.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.14 107.26 0.22 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.635 2.374 . . . . 10.0 114.339 -176.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.03 11.34 58.35 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 126.084 1.802 . . . . 10.0 115.045 173.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 161.89 4.21 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.174 0.987 . . . . 10.0 110.403 166.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 62.77 44.43 6.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.564 1.546 . . . . 10.0 113.121 -155.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 164.08 -44.13 0.31 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.452 1.501 . . . . 10.0 111.034 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.405 HH21 ' HB3' ' A' ' 42' ' ' GLN . 25.0 mtp85 -82.24 159.09 23.29 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.411 0.624 . . . . 10.0 111.495 169.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -85.36 164.92 17.66 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.96 1.304 . . . . 10.0 111.66 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.9 t -60.65 151.35 29.35 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.882 1.273 . . . . 10.0 111.787 171.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.36 8.44 49.85 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 117.154 1.622 . . . . 10.0 117.154 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.552 ' NE2' ' H ' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -65.87 -15.73 63.19 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 115.604 1.705 . . . . 10.0 115.604 -171.258 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.38 109.43 1.37 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.452 1.901 . . . . 10.0 114.868 -162.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.04 52.92 3.99 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.469 3.446 . . . . 10.0 112.395 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 126.94 73.84 0.19 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.498 1.523 . . . . 10.0 112.328 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -157.2 -79.94 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.918 0.887 . . . . 10.0 111.485 171.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 24.7 m 55.28 102.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.511 1.525 . . . . 10.0 112.176 -155.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -55.03 4.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.582 1.953 . . . . 10.0 110.305 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 71.9 p -144.69 175.81 9.89 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.216 2.606 . . . . 10.0 108.04 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -76.6 -60.48 2.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.804 1.642 . . . . 10.0 112.84 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.16 -52.45 65.29 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.766 1.226 . . . . 10.0 113.883 -153.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -58.82 -58.87 6.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.599 0.76 . . . . 10.0 112.885 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -39.95 76.34 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.528 1.131 . . . . 10.0 113.139 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -61.67 -34.91 76.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.178 0.899 . . . . 10.0 113.241 173.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -75.13 -10.99 59.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.118 1.525 . . . . 10.0 115.118 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.06 12.29 57.23 Favored Glycine 0 CA--C 1.542 1.781 0 N-CA-C 117.663 1.825 . . . . 10.0 117.663 163.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -55.4 4.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 119.449 3.129 . . . . 10.0 119.449 -161.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 m 55.62 104.58 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.825 2.45 . . . . 10.0 114.625 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.53 119.49 16.82 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 121.182 -0.949 . . . . 10.0 111.777 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -163.81 167.84 20.34 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.593 1.157 . . . . 10.0 111.146 -155.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -68.61 23.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.81 2.844 . . . . 10.0 114.427 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -158.91 17.48 0.19 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.895 2.878 . . . . 10.0 110.651 -168.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.7 p -158.45 -37.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.244 1.818 . . . . 10.0 110.656 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.64 HD22 HH12 ' A' ' 91' ' ' ARG . 1.0 OUTLIER -75.38 -22.27 57.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 114.424 1.268 . . . . 10.0 114.424 174.636 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.7 mtm -67.76 -52.73 33.93 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.88 0.763 . . . . 10.0 110.686 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -61.97 -41.47 98.04 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.46 0.475 . . . . 10.0 110.527 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.76 -53.23 43.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 113.316 0.858 . . . . 10.0 113.316 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.7 tp -65.96 -33.47 75.9 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.062 1.301 . . . . 10.0 112.415 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -70.34 -28.3 65.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 172.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -161.38 75.94 2.42 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.626 1.17 . . . . 10.0 112.353 -172.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.99 -48.68 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.612 2.208 . . . . 10.0 111.93 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 32.38 0.08 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.35 2.26 . . . . 10.0 114.268 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.26 -43.65 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 128.006 2.522 . . . . 10.0 110.45 -167.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -68.06 -36.82 80.5 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 174.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.44 143.55 41.57 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.702 0.801 . . . . 10.0 111.224 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -76.72 158.75 35.4 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.151 2.568 . . . . 10.0 111.379 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 57.49 55.8 28.5 Favored Glycine 0 C--N 1.34 0.778 0 C-N-CA 123.868 0.747 . . . . 10.0 112.044 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -126.68 151.01 48.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.125 1.77 . . . . 10.0 109.445 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -142.55 5.92 1.63 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.332 1.453 . . . . 10.0 113.87 -169.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -54.75 92.64 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.746 1.618 . . . . 10.0 113.035 173.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.77 83.22 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.484 1.514 . . . . 10.0 110.069 175.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -162.3 -53.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.069 0.766 . . . . 10.0 113.069 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.71 87.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.078 2.551 . . . . 10.0 117.254 168.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.78 95.87 1.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 123.374 0.511 . . . . 10.0 112.134 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.65 -21.11 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -166.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 73.63 148.33 0.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.162 2.585 . . . . 10.0 110.943 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm 46.95 -13.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 130.554 3.541 . . . . 10.0 118.298 -162.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.6 mttm 49.11 -9.72 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 131.406 3.882 . . . . 10.0 118.754 163.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.0 m -63.9 -26.77 68.75 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 122.726 2.512 . . . . 10.0 111.188 156.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -53.29 -33.32 52.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.195 0.998 . . . . 10.0 112.955 163.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.64 HH12 HD22 ' A' ' 64' ' ' LEU . 3.9 tpm_? -66.59 -44.49 82.02 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 116.981 -1.485 . . . . 10.0 110.404 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.17 -45.42 93.15 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.419 1.009 . . . . 10.0 110.335 177.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.424 ' HA ' ' H ' ' A' ' 2' ' ' ASP . 77.2 m-20 -59.79 -49.42 77.8 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.467 1.507 . . . . 10.0 110.911 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -40.95 97.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.469 0.914 . . . . 10.0 113.469 174.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.8 mm -54.71 -56.2 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 171.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.54 42.76 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.028 0.931 . . . . 10.0 111.075 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.446 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 9.2 t80 -52.0 -59.11 4.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.081 1.752 . . . . 10.0 112.36 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.446 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 15.1 mt -71.51 -30.91 66.48 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.946 0.794 . . . . 10.0 113.01 -175.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.444 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -61.43 -52.97 62.37 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 118.995 0.816 . . . . 10.0 109.862 171.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -37.72 82.51 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 117.453 -1.26 . . . . 10.0 113.189 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.73 -7.18 4.45 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.8 p -69.41 -16.92 63.6 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.883 -1.136 . . . . 10.0 113.538 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -153.61 43.73 0.59 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.77 1.228 . . . . 10.0 111.8 -162.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 129.635 3.174 . . . . 10.0 110.506 163.276 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.019 0 N-CA-C 109.693 -1.363 . . . . 10.0 109.693 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -109.33 150.56 27.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.147 0.979 . . . . 10.0 111.562 -174.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.6 m -70.8 -40.27 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 121.244 -0.91 . . . . 10.0 112.24 -174.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 mp0 -59.12 -51.84 68.3 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.425 1.49 . . . . 10.0 110.288 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -56.93 -21.61 31.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.995 1.718 . . . . 10.0 114.167 174.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.74 -43.04 3.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 119.074 0.852 . . . . 10.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -60.8 -42.04 96.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.797 1.298 . . . . 10.0 112.757 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -36.51 81.8 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.55 1.14 . . . . 10.0 112.627 -176.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.569 HG23 HD11 ' A' ' 94' ' ' LEU . 9.8 tp -85.99 -34.53 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 124.059 0.944 . . . . 10.0 111.217 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -57.35 -50.88 71.54 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 118.929 0.786 . . . . 10.0 110.318 171.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.4 t -65.01 -8.1 5.05 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -97.67 -48.69 5.13 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.241 1.417 . . . . 10.0 112.56 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' HD11 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -121.75 -0.24 9.68 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.391 1.626 . . . . 10.0 115.391 -171.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.2 m -117.61 -43.47 2.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.862 1.265 . . . . 10.0 111.655 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.88 -10.09 8.47 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -16.62 52.6 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 10.0 112.854 167.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.1 m -143.24 -34.82 0.41 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.468 1.507 . . . . 10.0 114.002 -175.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -105.45 174.25 5.96 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.362 2.665 . . . . 10.0 111.837 -178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.0 m -160.92 90.29 0.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 119.735 -1.853 . . . . 10.0 112.732 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.8 p -95.76 -36.26 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 N-CA-C 114.103 1.149 . . . . 10.0 114.103 171.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.96 -0.73 12.22 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.838 -1.164 . . . . 10.0 114.061 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -151.54 -166.27 2.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.057 2.543 . . . . 10.0 107.115 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.692 0 N-CA-C 118.058 1.983 . . . . 10.0 118.058 -167.188 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 119.22 -0.419 . . . . 10.0 111.903 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -116.97 171.67 13.9 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 110.499 -1.04 . . . . 10.0 110.499 154.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -61.65 178.98 0.56 Allowed 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.846 5.031 . . . . 10.0 114.167 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -83.53 -10.24 58.43 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.325 1.602 . . . . 10.0 115.325 -168.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.4 mp 45.5 69.42 0.45 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.618 1.167 . . . . 10.0 110.59 -158.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.413 ' CE1' HH21 ' A' ' 38' ' ' ARG . 0.5 OUTLIER -55.56 -179.24 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.64 1.176 . . . . 10.0 111.51 163.19 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -36.53 137.92 0.45 Allowed Glycine 0 CA--C 1.538 1.523 0 O-C-N 121.491 -0.756 . . . . 10.0 112.356 161.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -151.86 171.74 17.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 130.064 3.346 . . . . 10.0 109.097 -167.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 68.38 86.19 0.13 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.03 1.732 . . . . 10.0 112.784 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.4 60.71 1.43 Allowed Glycine 0 CA--C 1.527 0.809 0 CA-C-N 115.016 -0.993 . . . . 10.0 112.989 172.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.413 HH21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -152.21 -94.26 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.494 1.118 . . . . 10.0 110.328 172.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -154.5 -129.41 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.651 1.18 . . . . 10.0 110.608 165.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.9 t -158.63 167.69 28.89 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 128.33 2.652 . . . . 10.0 108.082 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.18 46.29 4.17 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 115.98 1.152 . . . . 10.0 115.98 174.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -128.94 1.0 5.32 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.651 1.723 . . . . 10.0 115.651 -173.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.85 116.91 27.39 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 120.855 1.661 . . . . 10.0 112.225 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.83 -39.25 0.69 Allowed 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.495 2.13 . . . . 10.0 114.197 -158.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -119.15 49.08 0.89 Allowed Glycine 0 C--N 1.34 0.788 0 C-N-CA 124.439 1.018 . . . . 10.0 112.322 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -141.72 -41.04 0.36 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 118.384 -0.817 . . . . 10.0 113.172 -172.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 t 43.91 87.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.493 1.917 . . . . 10.0 115.297 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -172.9 4.03 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 126.647 1.979 . . . . 10.0 113.283 -172.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.7 p -64.13 155.45 31.49 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.222 -0.924 . . . . 10.0 111.793 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.18 -50.39 16.39 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.847 2.059 . . . . 10.0 112.41 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.32 30.64 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 128.379 2.672 . . . . 10.0 116.464 -164.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -161.23 -70.16 0.06 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.039 3.336 . . . . 10.0 107.145 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -55.3 22.59 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.997 1.719 . . . . 10.0 112.555 178.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.9 -32.34 73.8 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.269 0.94 . . . . 10.0 112.021 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -60.66 -16.56 40.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.011 1.325 . . . . 10.0 113.337 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.68 14.93 79.51 Favored Glycine 0 CA--C 1.535 1.308 0 N-CA-C 115.914 1.126 . . . . 10.0 115.914 163.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -55.45 0.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.219 2.607 . . . . 10.0 117.993 -167.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.8 m 55.47 107.51 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 128.941 2.896 . . . . 10.0 115.161 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -67.82 131.63 45.88 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.747 0.784 . . . . 10.0 112.576 170.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -165.1 162.66 20.35 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.348 1.459 . . . . 10.0 110.682 -155.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.35 35.28 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 129.399 3.08 . . . . 10.0 113.602 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -162.06 -74.54 0.05 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 128.235 2.614 . . . . 10.0 107.578 -164.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.4 p -57.88 -37.03 73.24 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.064 2.145 . . . . 10.0 112.582 -176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.42 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.92 -23.61 55.49 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.765 1.226 . . . . 10.0 113.68 176.024 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 35.7 mtm -71.99 -48.27 46.05 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.65 -0.656 . . . . 10.0 109.948 170.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -57.5 -51.79 68.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.657 1.183 . . . . 10.0 110.829 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -59.3 -52.03 67.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 118.308 -0.853 . . . . 10.0 112.44 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.404 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -63.36 -48.04 79.59 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.591 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HA ' ' HA2' ' A' ' 84' ' ' GLY . 14.1 mm-40 -62.6 -29.13 70.37 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.27 1.211 . . . . 10.0 114.27 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -162.25 97.71 1.17 Allowed Pre-proline 0 CA--C 1.546 0.8 0 CA-C-N 119.156 0.889 . . . . 10.0 112.01 161.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.14 -49.22 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.398 2.065 . . . . 10.0 110.838 -172.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -61.4 -23.19 65.63 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.956 1.702 . . . . 10.0 113.775 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -52.56 9.54 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.028 1.331 . . . . 10.0 112.273 163.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -61.85 -32.38 72.71 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.122 0.786 . . . . 10.0 113.122 -175.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.54 148.0 54.42 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 126.077 1.751 . . . . 10.0 110.82 172.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.42 -8.45 19.59 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.94 2.427 . . . . 10.0 114.094 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -141.25 78.52 0.29 Allowed Glycine 0 C--N 1.34 0.763 0 C-N-CA 123.938 0.78 . . . . 10.0 113.126 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.7 m -133.91 119.46 19.14 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.746 0.818 . . . . 10.0 113.091 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -85.99 6.12 30.18 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 116.016 1.858 . . . . 10.0 116.016 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.57 109.32 0.68 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.438 1.095 . . . . 10.0 111.364 173.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 26.0 mm -83.74 77.31 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 124.999 1.319 . . . . 10.0 110.035 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -163.85 -42.74 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 167.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.67 -146.19 0.2 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.296 1.038 . . . . 10.0 113.198 -162.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 69' ' ' GLU . . . -57.0 150.26 28.86 Favored Glycine 0 C--N 1.343 0.949 0 C-N-CA 124.607 1.099 . . . . 10.0 115.479 -163.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 tt -69.58 -9.86 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.552 1.316 . . . . 10.0 114.552 -163.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.2 tttm 56.68 51.11 11.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.686 1.994 . . . . 10.0 111.716 -178.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.31 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.046 1.738 . . . . 10.0 115.235 175.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 mptt 47.5 -56.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 129.441 3.096 . . . . 10.0 116.351 -162.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.5 m -58.66 -37.61 76.36 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 121.358 1.89 . . . . 10.0 112.495 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -52.75 -38.47 60.96 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.356 0.662 . . . . 10.0 111.86 171.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.42 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -61.17 -46.69 89.48 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.839 -1.163 . . . . 10.0 110.932 -178.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.95 -22.77 55.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.783 1.031 . . . . 10.0 113.783 175.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -62.85 -49.76 73.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.813 1.188 . . . . 10.0 110.264 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.569 HD11 HG23 ' A' ' 9' ' ' ILE . 3.6 mp -59.51 -40.58 87.58 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.148 -0.97 . . . . 10.0 113.29 174.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.59 -48.79 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 119.053 0.842 . . . . 10.0 109.022 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -50.23 74.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.101 0.409 . . . . 10.0 111.344 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -53.71 -55.73 23.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.006 1.323 . . . . 10.0 112.847 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.97 -28.71 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.326 0.966 . . . . 10.0 112.608 -175.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -66.63 -18.96 65.65 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.376 1.071 . . . . 10.0 112.625 171.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -85.95 -58.19 2.74 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 117.223 -1.37 . . . . 10.0 111.377 158.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.16 -18.62 37.85 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 115.948 1.833 . . . . 10.0 115.948 -170.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.2 t -64.19 -19.97 65.7 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.011 1.324 . . . . 10.0 114.509 166.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.22 -4.21 0.2 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.538 2.051 . . . . 10.0 116.538 -167.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 C--O 1.25 1.095 0 C-N-CA 126.155 1.782 . . . . 10.0 111.274 -171.525 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 CA-C-O 118.111 -1.383 . . . . 10.0 114.828 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -80.7 163.98 23.15 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.606 1.703 . . . . 10.0 111.442 166.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.03 -50.3 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.678 1.191 . . . . 10.0 110.597 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.36 -49.95 65.16 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.951 -1.093 . . . . 10.0 113.114 -170.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -57.29 -32.1 66.3 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.732 0.413 . . . . 10.0 111.527 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.34 -41.74 58.32 Favored Glycine 0 C--N 1.34 0.754 0 C-N-CA 124.535 1.064 . . . . 10.0 111.287 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -69.7 -33.8 73.02 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 118.15 0.975 . . . . 10.0 111.978 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -53.58 55.9 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.932 1.293 . . . . 10.0 110.311 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.96 -33.19 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 118.61 -0.709 . . . . 10.0 112.696 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.7 t80 -56.59 -54.08 50.18 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 119.725 1.148 . . . . 10.0 110.723 170.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.87 -10.09 6.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 112.932 0.715 . . . . 10.0 112.932 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -90.06 -52.32 5.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.195 1.398 . . . . 10.0 111.354 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -134.55 10.12 3.7 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -167.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.0 m -113.26 -42.29 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.11 1.364 . . . . 10.0 110.719 167.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.35 -14.61 19.54 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -66.13 -10.28 39.41 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.923 1.689 . . . . 10.0 114.741 168.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -143.43 -34.68 0.4 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.76 1.224 . . . . 10.0 112.98 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -114.41 -175.42 2.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.597 2.359 . . . . 10.0 111.956 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -146.04 176.74 9.49 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.317 0.647 . . . . 10.0 110.756 151.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.3 p -162.34 -41.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 127.139 2.176 . . . . 10.0 109.765 156.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -67.47 -51.9 45.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.996 0.918 . . . . 10.0 111.091 166.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -85.26 82.87 8.19 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.5 1.12 . . . . 10.0 110.158 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.23 0 C-N-CA 127.341 2.401 . . . . 10.0 115.757 167.567 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 119.499 -0.286 . . . . 10.0 110.957 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -144.51 175.92 23.97 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.814 2.15 . . . . 10.0 110.82 160.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.07 -179.18 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.273 3.982 . . . . 10.0 113.936 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -93.68 16.27 14.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.347 2.659 . . . . 10.0 115.741 -169.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp 38.85 55.1 2.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.99 2.116 . . . . 10.0 112.924 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -56.94 84.73 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.595 2.758 . . . . 10.0 114.112 -178.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.25 32.19 60.07 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.413 1.482 . . . . 10.0 114.962 166.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.0 179.25 0.71 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.183 0.993 . . . . 10.0 113.429 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.604 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 4.1 m-85 52.81 42.95 31.98 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 124.802 1.241 . . . . 10.0 111.068 -166.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 1.68 0.07 OUTLIER Glycine 0 CA--C 1.542 1.77 0 C-N-CA 126.945 2.212 . . . . 10.0 115.208 -163.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.9 mtp85 -152.41 163.33 39.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.118 1.767 . . . . 10.0 110.848 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -83.72 172.76 11.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.02 2.128 . . . . 10.0 112.999 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 50.6 p -81.73 179.63 7.75 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.581 1.152 . . . . 10.0 112.125 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.72 -32.1 4.07 Favored Glycine 0 CA--C 1.529 0.956 0 O-C-N 120.88 -1.137 . . . . 10.0 114.5 176.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 44.3 mm-40 -64.98 6.32 0.25 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 128.708 2.803 . . . . 10.0 116.623 -161.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.17 145.0 79.76 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 119.405 1.002 . . . . 10.0 108.939 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.57 70.31 4.97 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.415 2.743 . . . . 10.0 111.323 -177.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.35 -79.27 0.23 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.918 1.723 . . . . 10.0 111.987 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 48.62 -14.33 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 130.438 3.495 . . . . 10.0 117.883 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 m 76.38 75.82 0.09 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 129.787 3.235 . . . . 10.0 112.025 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -84.27 170.0 14.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.943 1.297 . . . . 10.0 111.849 159.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 82.1 p -69.59 -1.37 8.64 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 116.226 1.936 . . . . 10.0 116.226 -172.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.4 t70 46.3 -157.33 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.456 0.702 . . . . 10.0 110.912 -146.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.25 -76.12 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.357 2.663 . . . . 10.0 113.147 -168.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -49.94 -71.64 0.06 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.212 1.805 . . . . 10.0 111.4 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -57.07 -42.3 80.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.616 1.966 . . . . 10.0 111.246 -172.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.11 -59.9 3.61 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.591 2.356 . . . . 10.0 112.525 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -62.29 -52.01 65.41 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.905 0.882 . . . . 10.0 111.552 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.3 -179.99 19.01 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 122.436 1.02 . . . . 10.0 115.203 -172.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.07 -1.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 128.747 2.819 . . . . 10.0 112.544 -169.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.8 m 55.39 106.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.86 2.064 . . . . 10.0 113.181 -162.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -67.38 123.15 19.57 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.31 -0.869 . . . . 10.0 111.692 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -162.57 178.15 8.81 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.172 2.189 . . . . 10.0 110.907 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.91 41.93 0.05 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.127 2.971 . . . . 10.0 113.344 -174.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -161.64 -64.45 0.05 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.563 3.145 . . . . 10.0 108.396 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.1 p -62.48 -43.81 97.92 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.176 1.39 . . . . 10.0 112.416 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.69 -25.3 60.17 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.131 0.573 . . . . 10.0 111.405 173.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 34.3 ttm -63.95 -52.42 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.204 0.911 . . . . 10.0 109.234 170.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -60.86 -44.67 96.7 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.499 0.72 . . . . 10.0 111.146 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.29 -48.27 76.31 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.499 -0.762 . . . . 10.0 111.674 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -42.16 99.01 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.079 1.308 . . . . 10.0 111.066 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.97 -45.51 74.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.107 0.867 . . . . 10.0 112.282 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -160.6 76.77 2.62 Favored Pre-proline 0 CA--C 1.559 1.307 0 C-N-CA 124.656 1.182 . . . . 10.0 111.034 -163.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.92 -67.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.473 3.449 . . . . 10.0 114.271 -161.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -58.64 -20.29 46.56 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.176 1.79 . . . . 10.0 113.233 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -48.06 24.58 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.828 2.051 . . . . 10.0 111.428 170.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -61.19 -41.1 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.629 0.772 . . . . 10.0 112.855 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 pt -139.53 135.89 17.29 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.711 0.805 . . . . 10.0 111.208 -175.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -78.37 65.92 8.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.438 3.425 . . . . 10.0 112.786 -168.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.36 -145.96 4.65 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 126.423 1.963 . . . . 10.0 109.614 175.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 93.0 m 74.86 147.6 0.09 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.065 2.146 . . . . 10.0 114.636 168.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -141.56 21.6 2.18 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.946 2.098 . . . . 10.0 111.666 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 21.7 ttt -59.49 98.6 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.156 1.382 . . . . 10.0 109.561 158.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.5 mp -75.57 57.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.262 1.025 . . . . 10.0 110.3 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -163.64 107.05 0.99 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.29 1.036 . . . . 10.0 111.417 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.89 -162.04 0.2 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.096 1.358 . . . . 10.0 111.942 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.26 60.26 0.01 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 127.58 2.514 . . . . 10.0 117.051 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.331 5.6 tt 44.71 -122.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.343 2.657 . . . . 10.0 112.042 175.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -142.31 -73.8 0.3 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.31 1.444 . . . . 10.0 110.15 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.81 115.52 3.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 161.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -64.04 -21.71 66.62 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.133 0.879 . . . . 10.0 111.373 170.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.7 m -53.1 -50.91 63.46 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.145 0.978 . . . . 10.0 112.339 164.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.25 -30.36 66.49 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.551 1.069 . . . . 10.0 111.341 176.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -19.57 59.48 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.545 1.138 . . . . 10.0 113.869 173.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.76 -62.97 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.398 1.454 . . . . 10.0 108.189 160.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.58 -48.48 72.05 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 126.458 1.903 . . . . 10.0 111.198 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.2 tp -60.44 -47.7 84.96 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.7 mm -65.57 -44.02 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.905 -0.497 . . . . 10.0 110.075 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.53 -35.39 80.33 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.217 1.007 . . . . 10.0 111.609 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.445 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.0 t80 -57.12 -66.44 0.45 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.675 1.19 . . . . 10.0 110.952 165.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 51.7 mt -62.86 -29.9 71.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.604 ' HE2' ' HB3' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -57.46 -46.92 83.11 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.54 1.064 . . . . 10.0 110.983 172.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -91.22 -38.24 12.82 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 117.983 -1.008 . . . . 10.0 111.684 -172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.71 -13.33 9.53 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.837 1.655 . . . . 10.0 115.013 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.58 -2.38 14.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.581 1.152 . . . . 10.0 113.346 168.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -151.4 -53.8 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.73 2.012 . . . . 10.0 111.816 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 126.697 1.999 . . . . 10.0 113.215 -178.176 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.768 0 CA-C-O 118.716 -1.047 . . . . 10.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -136.82 155.2 50.11 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.475 0.917 . . . . 10.0 113.475 -144.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 94.6 t -58.57 -56.09 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 126.183 1.793 . . . . 10.0 111.544 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -59.46 -36.46 75.99 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.37 1.468 . . . . 10.0 112.004 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -77.75 -8.97 58.73 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.221 1.808 . . . . 10.0 114.666 174.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.23 -41.47 5.51 Favored Glycine 0 N--CA 1.471 1.0 0 CA-C-N 119.707 1.14 . . . . 10.0 112.092 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.08 68.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.726 -0.867 . . . . 10.0 113.036 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -30.07 67.71 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.492 1.293 . . . . 10.0 114.492 177.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -86.11 -31.1 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 119.026 0.83 . . . . 10.0 110.325 173.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t80 -58.08 -52.02 67.26 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 122.072 -0.393 . . . . 10.0 111.336 169.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.86 -9.89 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.366 0.876 . . . . 10.0 113.366 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -82.55 -52.18 7.08 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.055 0.942 . . . . 10.0 110.742 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -116.06 -52.67 2.59 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.285 1.034 . . . . 10.0 112.595 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 9.5 m -59.53 -43.01 93.59 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.902 0.881 . . . . 10.0 112.666 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.417 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -62.9 -12.2 23.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.658 1.355 . . . . 10.0 114.658 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.88 -14.77 63.11 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.618 1.099 . . . . 10.0 112.252 170.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 91.7 m -143.03 -26.95 0.58 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.665 1.358 . . . . 10.0 114.665 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.426 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.4 m-70 -109.54 -56.26 2.33 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.201 1.4 . . . . 10.0 114.127 -174.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.417 ' H ' ' HA ' ' A' ' 15' ' ' ALA 0.294 9.8 t 44.67 53.31 7.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.187 1.795 . . . . 10.0 114.016 -175.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.71 -28.38 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 120.789 -1.194 . . . . 10.0 112.752 175.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.82 4.74 0.26 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.542 1.937 . . . . 10.0 114.712 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -149.79 13.57 0.81 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.75 2.42 . . . . 10.0 111.501 169.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.173 0 C-N-CA 124.86 1.219 . . . . 10.0 112.957 -173.17 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 113.332 0.864 . . . . 10.0 113.332 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.99 165.82 21.65 Favored Glycine 0 CA--C 1.54 1.656 0 CA-C-N 119.645 1.111 . . . . 10.0 110.99 157.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 49.3 Cg_endo -67.96 22.86 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.045 1 C-N-CA 126.478 4.785 . . . . 10.0 116.342 -173.728 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.349 0.0 OUTLIER 49.56 6.38 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 128.726 2.811 . . . . 10.0 117.931 -169.561 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.11 -34.21 0.28 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.728 2.411 . . . . 10.0 113.966 171.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.43 68.11 0.17 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 131.148 3.779 . . . . 10.0 114.13 169.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 32.85 68.05 0.18 Allowed Glycine 0 C--N 1.345 1.061 0 C-N-CA 127.587 2.517 . . . . 10.0 113.456 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -93.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.661 0.785 . . . . 10.0 112.322 -164.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 33.86 62.05 0.46 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.749 2.42 . . . . 10.0 115.358 161.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.35 -24.32 16.11 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.095 1.807 . . . . 10.0 114.151 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -68.06 168.18 12.5 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.955 1.378 . . . . 10.0 111.059 164.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -84.96 166.04 17.09 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.082 1.141 . . . . 10.0 114.082 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.4 p -67.55 -71.57 0.2 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 128.42 2.688 . . . . 10.0 112.964 -174.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -73.5 67.7 1.55 Allowed Glycine 0 C--N 1.339 0.703 0 C-N-CA 126.99 2.233 . . . . 10.0 112.988 -171.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.86 -2.98 7.73 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -173.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.06 118.84 59.47 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.551 1.14 . . . . 10.0 111.592 -176.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.89 81.75 1.86 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.069 2.513 . . . . 10.0 113.088 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.96 -7.75 70.09 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 125.403 1.478 . . . . 10.0 115.249 170.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -64.37 113.72 3.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.047 1.339 . . . . 10.0 110.615 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 m -71.18 142.55 50.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.399 1.48 . . . . 10.0 111.657 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.619 ' CG ' ' HE3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -155.0 178.41 10.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.082 1.142 . . . . 10.0 114.082 -169.221 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 p -67.52 120.93 14.77 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 10.0 111.924 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -75.07 36.38 0.11 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.676 1.59 . . . . 10.0 113.601 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.97 11.45 2.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.128 1.371 . . . . 10.0 114.625 -166.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.66 -33.97 0.05 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 117.905 -1.045 . . . . 10.0 113.791 -168.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HE3' ' CG ' ' A' ' 48' ' ' TYR . 1.7 mppt? -64.48 -48.81 73.83 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.763 1.165 . . . . 10.0 108.071 166.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -49.01 -34.89 14.07 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.133 3.773 . . . . 10.0 113.82 176.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -68.71 -16.36 63.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.832 1.049 . . . . 10.0 113.832 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.94 5.13 57.3 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.296 1.279 . . . . 10.0 116.296 165.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.9 pp -61.24 14.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 128.995 2.918 . . . . 10.0 116.706 -173.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 99.9 m 40.6 81.14 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.568 2.747 . . . . 10.0 112.504 155.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -54.6 137.08 44.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.167 1.387 . . . . 10.0 111.692 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.258 0.0 OUTLIER -161.46 -73.72 0.06 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.734 1.383 . . . . 10.0 114.734 -164.006 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -164.68 20.32 0.06 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 121.145 1.793 . . . . 10.0 113.092 -171.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -160.72 -63.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.963 1.305 . . . . 10.0 107.898 -162.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 46.3 p -60.81 -46.82 89.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 126.979 2.112 . . . . 10.0 110.651 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -28.86 66.47 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.932 1.293 . . . . 10.0 112.324 174.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.7 ttm -65.13 -51.13 63.1 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.053 0.541 . . . . 10.0 109.854 173.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -61.56 -46.18 90.99 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.269 1.028 . . . . 10.0 110.352 176.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.29 -53.01 50.31 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 118.585 -0.721 . . . . 10.0 112.799 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -26.44 66.71 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.257 1.389 . . . . 10.0 111.798 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.53 -25.2 45.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.976 1.473 . . . . 10.0 114.976 169.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.46 72.25 1.87 Allowed Pre-proline 0 CA--C 1.563 1.451 0 CA-C-N 119.746 1.157 . . . . 10.0 113.442 -174.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -71.5 -57.54 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.454 2.103 . . . . 10.0 113.283 -161.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.8 mttm -62.6 -27.88 69.5 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 127.081 2.153 . . . . 10.0 112.456 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.28 -46.62 32.38 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 126.284 1.834 . . . . 10.0 110.764 172.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -61.03 -49.29 78.01 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.271 0.841 . . . . 10.0 113.271 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 pt -135.97 131.29 18.86 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.661 0.784 . . . . 10.0 111.155 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -80.75 64.71 8.92 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.228 3.285 . . . . 10.0 113.33 -159.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 149.85 88.67 0.07 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 123.769 0.699 . . . . 10.0 111.59 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 19.0 m -143.89 100.26 3.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.616 1.166 . . . . 10.0 109.407 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -81.35 7.99 10.26 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.383 1.873 . . . . 10.0 115.0 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.3 ttt -50.14 107.55 0.17 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.106 0.866 . . . . 10.0 110.379 156.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.435 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.0 mp -78.49 59.2 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.936 1.295 . . . . 10.0 110.521 -175.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -162.93 92.44 0.77 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.307 1.043 . . . . 10.0 110.358 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.36 -14.62 60.48 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.453 1.649 . . . . 10.0 115.453 -172.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -179.95 159.09 23.22 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.753 1.168 . . . . 10.0 111.19 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' H ' ' A' ' 86' ' ' LYS 0.315 20.5 tt -96.06 -96.29 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 -168.255 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.665 ' H ' HG23 ' A' ' 85' ' ' ILE . 9.3 mmpt? -146.83 103.4 3.63 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.017 1.327 . . . . 10.0 110.995 -171.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 47.22 -73.7 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 129.352 3.061 . . . . 10.0 114.421 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -164.18 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.825 1.65 . . . . 10.0 112.931 157.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 m -52.71 -52.29 56.74 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.771 1.228 . . . . 10.0 112.592 -171.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -58.89 -26.37 64.22 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.984 0.811 . . . . 10.0 112.622 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -23.66 58.18 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.559 0.743 . . . . 10.0 112.251 176.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -70.28 -53.89 14.96 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.085 -1.009 . . . . 10.0 110.101 168.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.08 -47.32 78.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 10.0 110.544 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 45.5 tp -56.93 -48.29 78.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.735 1.614 . . . . 10.0 113.821 172.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 15.4 mm -61.69 -44.36 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 118.858 0.754 . . . . 10.0 109.911 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.22 84.05 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.548 0.739 . . . . 10.0 111.82 175.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -55.62 -60.51 3.33 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.52 0.728 . . . . 10.0 111.756 171.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.77 -21.65 62.48 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.794 1.179 . . . . 10.0 113.99 -172.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.76 -59.77 4.26 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.485 0.714 . . . . 10.0 109.989 159.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 mmtt -61.89 -28.23 69.36 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.36 -1.305 . . . . 10.0 113.387 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.72 -13.92 7.24 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.801 1.637 . . . . 10.0 114.698 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.8 p -74.61 -20.58 59.86 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.882 1.438 . . . . 10.0 114.882 166.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -155.8 15.87 0.36 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 115.175 1.546 . . . . 10.0 115.175 -164.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 115.314 -2.279 . . . . 10.0 113.819 173.636 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 111.013 -0.835 . . . . 10.0 111.013 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.06 151.51 28.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.32 2.248 . . . . 10.0 114.404 -163.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -58.13 -35.62 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 120.763 -1.21 . . . . 10.0 113.228 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 -63.81 -48.89 75.06 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.564 1.546 . . . . 10.0 111.216 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -57.57 -34.11 68.85 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.589 0.755 . . . . 10.0 111.574 172.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.79 -51.61 39.54 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.15 -1.18 . . . . 10.0 110.15 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.259 1.1 ptpm? -64.16 -38.25 90.39 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 118.401 1.101 . . . . 10.0 113.657 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.26 -37.7 78.06 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.595 1.089 . . . . 10.0 113.357 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mm -69.4 -39.99 79.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 120.025 1.284 . . . . 10.0 110.96 172.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -56.38 -49.01 75.69 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.544 -0.723 . . . . 10.0 110.35 174.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.15 -11.59 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.976 1.102 . . . . 10.0 113.976 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -84.95 -33.75 22.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.329 1.051 . . . . 10.0 112.275 -177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -132.02 -63.52 0.81 Allowed 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 126.159 1.784 . . . . 10.0 111.148 -172.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 m -53.64 -47.73 70.05 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.551 1.14 . . . . 10.0 112.784 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.24 -17.57 62.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.046 1.128 . . . . 10.0 114.046 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.01 -7.82 32.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.268 1.427 . . . . 10.0 112.781 174.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -141.67 -21.28 0.74 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.613 1.565 . . . . 10.0 113.186 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -126.23 -5.74 6.62 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -170.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.2 m 54.94 -79.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.934 2.093 . . . . 10.0 116.193 -177.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.8 t 46.95 -59.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.276 1 C-N-CA 131.711 4.004 . . . . 10.0 116.041 -167.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -71.72 14.05 0.23 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.511 1.924 . . . . 10.0 113.687 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -153.78 -166.53 2.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.474 2.71 . . . . 10.0 108.522 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.716 0 C-N-CA 125.552 1.548 . . . . 10.0 116.332 179.781 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 111.886 0.328 . . . . 10.0 111.886 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -138.8 173.66 22.48 Favored Glycine 0 CA--C 1.544 1.871 0 C-N-CA 126.51 2.005 . . . . 10.0 110.716 162.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 66.9 Cg_endo -71.64 -144.86 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.08 1 C-N-CA 125.379 4.052 . . . . 10.0 109.741 168.193 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -142.81 150.98 40.66 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 119.87 -1.769 . . . . 10.0 110.452 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.62 70.61 7.39 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 81.98 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 10.0 110.234 172.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.1 -67.78 0.48 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.584 2.516 . . . . 10.0 113.303 -176.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.11 -161.68 0.16 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.817 1.647 . . . . 10.0 111.064 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 60.43 64.37 1.22 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.204 1.801 . . . . 10.0 111.422 -173.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.7 42.58 0.86 Allowed Glycine 0 CA--C 1.532 1.151 0 CA-C-N 113.451 -1.704 . . . . 10.0 113.54 -172.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -150.95 150.5 30.89 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.21 1.404 . . . . 10.0 110.668 -177.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 163.59 18.41 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.909 1.077 . . . . 10.0 113.909 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.5 -16.62 58.61 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.278 1.831 . . . . 10.0 113.822 174.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.36 58.41 1.56 Allowed Glycine 0 CA--C 1.536 1.361 0 O-C-N 120.224 -1.547 . . . . 10.0 112.51 170.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -150.31 110.34 4.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.701 2.0 . . . . 10.0 112.238 -170.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.84 157.3 14.01 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.791 1.636 . . . . 10.0 110.376 165.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -84.81 -126.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 124.684 3.589 . . . . 10.0 109.215 159.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.92 79.78 0.37 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.368 1.461 . . . . 10.0 113.48 177.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.403 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 78.6 t80 -144.73 176.4 9.47 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.352 1.861 . . . . 10.0 110.714 172.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 96.7 m -154.39 100.03 2.25 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.881 -1.762 . . . . 10.0 110.832 171.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.61 167.64 16.07 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.338 2.255 . . . . 10.0 112.008 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.8 p -70.7 130.62 42.23 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.125 0.964 . . . . 10.0 111.051 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -33.2 71.86 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.364 1.616 . . . . 10.0 115.364 -162.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.25 -14.57 60.94 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.207 1.188 . . . . 10.0 114.207 -177.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -64.62 -70.06 0.25 Allowed 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.77 1.168 . . . . 10.0 110.244 169.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.16 -41.9 28.13 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.447 1.099 . . . . 10.0 112.104 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.17 -23.66 67.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.835 1.254 . . . . 10.0 114.002 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -74.01 -24.33 59.55 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.26 0.936 . . . . 10.0 112.677 170.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 65.32 12.62 56.22 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 116.844 1.498 . . . . 10.0 116.844 160.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.17 -12.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 129.221 3.008 . . . . 10.0 118.38 -160.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.0 m 56.73 118.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 128.197 2.599 . . . . 10.0 114.006 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 29.0 m95 -75.4 122.17 23.38 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.107 -0.951 . . . . 10.0 112.543 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -163.94 -177.94 5.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 130.207 3.403 . . . . 10.0 107.663 169.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -46.71 -57.94 4.35 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.956 1.253 . . . . 10.0 112.654 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -57.93 15.89 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 130.093 3.357 . . . . 10.0 116.691 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.8 p -158.15 -43.07 0.06 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.221 1.809 . . . . 10.0 109.976 -175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.82 -33.54 60.08 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.735 1.214 . . . . 10.0 113.102 174.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.6 tpp -65.93 -48.96 69.66 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.803 0.729 . . . . 10.0 109.472 174.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.74 -43.87 97.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.634 1.173 . . . . 10.0 109.953 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -58.02 -64.61 0.85 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.224 -0.893 . . . . 10.0 111.719 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -24.4 67.58 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.494 1.497 . . . . 10.0 113.686 -174.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -73.48 -22.87 60.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.745 1.387 . . . . 10.0 114.745 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.98 71.13 2.35 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 120.194 1.361 . . . . 10.0 111.487 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.68 -48.03 0.82 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.225 1.95 . . . . 10.0 111.506 -164.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.7 mtmt -70.28 33.43 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 128.313 2.645 . . . . 10.0 114.097 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -161.91 -39.14 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 127.114 2.165 . . . . 10.0 112.0 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -65.39 -34.21 77.78 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.169 0.44 . . . . 10.0 111.721 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.98 153.25 78.43 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.396 1.078 . . . . 10.0 111.022 171.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.38 93.81 0.75 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.058 3.172 . . . . 10.0 112.757 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.69 49.17 6.25 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.962 0.745 . . . . 10.0 114.962 161.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.1 m -65.39 -19.7 66.06 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.579 1.326 . . . . 10.0 114.579 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 64.87 -45.93 0.34 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.417 2.287 . . . . 10.0 115.653 -176.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.2 ttt 2.7 97.51 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 129.547 3.139 . . . . 10.0 115.393 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . 0.267 9.9 tp -76.12 74.72 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 122.547 1.165 . . . . 10.0 112.237 -178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -162.45 -66.6 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.35 1.86 . . . . 10.0 109.981 170.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.11 -0.56 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 119.927 3.306 . . . . 10.0 119.927 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.17 95.5 0.22 Allowed Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.765 1.621 . . . . 10.0 113.209 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 tp -67.27 159.46 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.904 0.882 . . . . 10.0 112.19 174.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -64.71 -42.03 95.58 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.946 1.298 . . . . 10.0 114.384 -174.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' THR . 3.6 ptpp? -162.97 170.21 18.42 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.585 1.954 . . . . 10.0 109.555 165.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -55.91 -32.1 63.46 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.408 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 12.4 m -56.87 -37.27 71.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.757 1.223 . . . . 10.0 113.235 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -77.19 -15.53 59.46 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.698 1.199 . . . . 10.0 114.147 171.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.477 HH21 HG12 ' A' ' 95' ' ' ILE . 0.0 OUTLIER -76.54 -48.76 18.33 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.237 -1.539 . . . . 10.0 110.866 166.429 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -54.53 -55.47 28.86 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.94 1.296 . . . . 10.0 111.775 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -63.69 -35.48 80.7 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.149 0.796 . . . . 10.0 113.149 -172.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.1 mp -62.08 -42.61 99.38 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.834 1.254 . . . . 10.0 112.687 170.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.477 HG12 HH21 ' A' ' 91' ' ' ARG . 21.8 mm -59.57 -50.89 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.592 0.633 . . . . 10.0 109.754 171.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.62 83.57 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.752 0.821 . . . . 10.0 112.045 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -56.6 -57.49 12.13 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.904 1.282 . . . . 10.0 111.635 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 82.3 mt -70.95 -25.88 62.92 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.927 1.239 . . . . 10.0 112.741 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? -61.07 -29.17 69.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.242 1.017 . . . . 10.0 112.637 165.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -76.54 -51.65 11.29 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 125.145 1.378 . . . . 10.0 110.989 163.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 98' ' ' LEU . . . -54.65 -22.51 13.85 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 121.474 1.943 . . . . 10.0 116.11 -174.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.8 0.73 12.24 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 169.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -153.92 -16.82 0.14 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 128.046 2.538 . . . . 10.0 115.499 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.255 1.356 0 C-N-CA 127.703 2.401 . . . . 10.0 111.792 -163.829 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.194 0 CA-C-O 118.217 -1.324 . . . . 10.0 113.642 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -134.55 118.0 16.79 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.627 . . . . 10.0 111.036 -139.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.7 p -50.27 -38.45 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.515 1.126 . . . . 10.0 112.658 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -59.78 -38.73 82.67 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.343 1.457 . . . . 10.0 113.724 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -73.98 -30.45 62.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.448 0.699 . . . . 10.0 110.766 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.47 -50.71 11.13 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 26.98 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.701 2.4 . . . . 10.0 115.146 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.01 -28.5 0.06 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.385 1.474 . . . . 10.0 112.693 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.4 tp -70.19 -37.24 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 120.775 1.625 . . . . 10.0 110.925 161.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -55.54 -51.0 68.53 Favored 'General case' 0 C--N 1.347 0.486 0 O-C-N 121.258 -0.901 . . . . 10.0 110.395 168.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 t -66.89 -8.33 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -96.19 -48.83 5.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.227 1.411 . . . . 10.0 112.169 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -125.07 6.26 7.91 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.668 1.729 . . . . 10.0 115.668 -166.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.4 m -122.61 -44.05 2.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.51 1.924 . . . . 10.0 111.011 172.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.68 -21.59 60.77 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -55.1 -11.61 0.73 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.894 2.078 . . . . 10.0 115.334 169.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.8 m -141.84 -30.22 0.59 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.079 1.752 . . . . 10.0 111.566 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.437 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.3 m-70 -105.89 -20.43 13.44 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.656 1.354 . . . . 10.0 114.656 -176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.1 p 56.13 12.96 1.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 118.364 2.727 . . . . 10.0 118.364 173.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.402 HG21 ' H ' ' A' ' 32' ' ' LEU . 4.0 t -66.29 165.45 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.273 1.829 . . . . 10.0 112.91 -173.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 87.95 0.15 0.44 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 130.14 3.376 . . . . 10.0 112.905 177.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -151.42 -172.1 4.12 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 128.493 2.717 . . . . 10.0 108.059 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.26 0 C-N-CA 125.221 1.391 . . . . 10.0 112.662 174.234 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 118.979 -0.534 . . . . 10.0 110.578 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.78 163.6 12.17 Favored Glycine 0 CA--C 1.544 1.871 0 N-CA-C 110.951 -0.86 . . . . 10.0 110.951 152.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 40.1 Cg_endo -75.8 0.43 9.23 Favored 'Trans proline' 0 CA--C 1.538 0.683 1 C-N-CA 125.784 4.323 . . . . 10.0 116.571 -175.258 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 64.92 145.34 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.987 2.515 . . . . 10.0 114.056 -163.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.402 ' H ' HG21 ' A' ' 20' ' ' VAL . 1.8 mm? -85.26 73.29 10.61 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.225 -0.922 . . . . 10.0 109.493 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -161.93 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.469 0.707 . . . . 10.0 112.271 162.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.21 53.44 0.08 OUTLIER Glycine 0 CA--C 1.54 1.656 0 C-N-CA 127.473 2.463 . . . . 10.0 117.894 -164.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -70.8 177.9 3.37 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.033 2.533 . . . . 10.0 111.094 171.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.288 61.9 m-85 63.02 39.35 10.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.578 1.951 . . . . 10.0 112.24 -161.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.37 45.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.302 0 N-CA-C 116.3 1.28 . . . . 10.0 116.3 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.45 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -152.82 -99.45 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.498 1.649 . . . . 10.0 112.917 174.589 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.45 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -178.35 -165.94 0.1 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 131.563 3.945 . . . . 10.0 107.779 174.346 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.3 t -76.56 -140.7 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.446 1.098 . . . . 10.0 110.228 158.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.4 -69.48 3.36 Favored Glycine 0 CA--C 1.528 0.897 0 O-C-N 120.216 -1.553 . . . . 10.0 112.946 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -64.51 133.58 52.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.617 0.767 . . . . 10.0 111.648 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.85 110.75 0.84 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.93 2.092 . . . . 10.0 108.712 163.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.28 77.59 2.03 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.241 2.627 . . . . 10.0 114.498 -162.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.75 52.46 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.234 1.397 . . . . 10.0 114.587 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -64.16 -59.73 4.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.493 1.917 . . . . 10.0 114.347 -171.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m 77.52 127.07 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.165 2.586 . . . . 10.0 112.691 -164.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.17 -179.41 8.12 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.109 2.564 . . . . 10.0 111.061 -167.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -70.17 158.87 35.0 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.469 -0.769 . . . . 10.0 111.264 168.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.76 -41.98 35.7 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.888 1.811 . . . . 10.0 115.888 -176.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.02 -24.58 47.8 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.926 1.824 . . . . 10.0 115.926 -156.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -60.62 -53.4 57.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.849 0.86 . . . . 10.0 111.614 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.27 20.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.229 1.412 . . . . 10.0 111.926 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -58.1 -29.27 65.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.317 1.447 . . . . 10.0 113.727 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -72.91 -20.82 61.01 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.483 1.038 . . . . 10.0 113.759 178.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 59.06 11.08 10.51 Favored Glycine 0 CA--C 1.545 1.937 0 N-CA-C 119.217 2.447 . . . . 10.0 119.217 148.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.9 pt -50.33 -101.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 129.402 3.081 . . . . 10.0 115.796 -170.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -155.1 -27.42 0.11 Allowed 'General case' 0 N--CA 1.48 1.073 0 O-C-N 119.928 -1.733 . . . . 10.0 115.105 -173.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER 40.15 95.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.294 2.238 . . . . 10.0 113.757 -159.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -163.17 -175.04 4.1 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.267 2.627 . . . . 10.0 109.066 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -44.18 -53.89 6.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.224 2.21 . . . . 10.0 113.124 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.97 19.67 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.303 2.241 . . . . 10.0 116.199 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.3 p -160.05 -45.73 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.364 1.465 . . . . 10.0 110.716 -165.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.74 -22.24 56.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.634 1.174 . . . . 10.0 111.835 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -60.42 3.62 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.571 -0.9 . . . . 10.0 108.571 165.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.2 -37.68 83.86 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 110.538 -0.171 . . . . 10.0 110.538 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -70.43 -51.71 27.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 118.018 -0.991 . . . . 10.0 113.258 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.43 -34.05 76.43 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.356 1.889 . . . . 10.0 113.236 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -72.86 -29.58 63.3 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.101 0.778 . . . . 10.0 113.101 174.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.28 72.43 2.25 Favored Pre-proline 0 CA--C 1.561 1.374 0 N-CA-C 113.695 0.998 . . . . 10.0 113.695 -173.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.39 -50.31 0.73 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.736 2.958 . . . . 10.0 112.887 -165.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.74 -36.11 71.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.64 1.976 . . . . 10.0 112.921 177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -30.29 58.1 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.587 1.555 . . . . 10.0 112.793 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -75.78 -52.92 9.36 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.865 1.061 . . . . 10.0 113.865 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.0 pt -128.93 139.77 36.66 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 118.558 0.617 . . . . 10.0 112.279 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.55 146.89 56.54 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.939 2.426 . . . . 10.0 111.874 -168.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.13 10.84 10.32 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.82 1.2 . . . . 10.0 115.717 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.46 139.22 49.54 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.956 1.878 . . . . 10.0 110.4 175.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -84.8 -61.1 1.86 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 117.214 -1.374 . . . . 10.0 112.675 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.1 ttt 8.84 83.29 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 128.719 2.807 . . . . 10.0 114.098 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.24 74.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.307 1.443 . . . . 10.0 109.911 -171.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -163.15 -52.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.097 0.959 . . . . 10.0 112.911 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 40.15 82.82 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.261 2.225 . . . . 10.0 116.163 172.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.02 105.27 2.86 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.171 0.891 . . . . 10.0 111.781 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.2 tt -62.55 -50.86 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.864 -0.786 . . . . 10.0 112.494 -172.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.0 mttt 161.45 174.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 1 C-N-CA 132.291 4.236 . . . . 10.0 109.299 161.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 10.5 mmpt? 43.64 -98.59 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.962 2.505 . . . . 10.0 112.195 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.85 -49.0 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 129.681 3.192 . . . . 10.0 109.519 173.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 m -49.82 -46.66 51.36 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.736 2.014 . . . . 10.0 112.669 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -56.94 -35.97 69.71 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.108 0.963 . . . . 10.0 112.159 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -41.0 63.4 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.512 0.597 . . . . 10.0 111.032 175.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.04 -47.1 78.5 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 118.724 0.693 . . . . 10.0 111.997 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -57.14 -45.86 83.18 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.534 1.534 . . . . 10.0 111.818 174.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.02 -47.15 78.36 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 124.455 1.102 . . . . 10.0 113.364 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.5 mm -62.61 -46.06 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 118.355 -0.831 . . . . 10.0 109.145 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.05 82.52 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.966 0.803 . . . . 10.0 112.576 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.02 -63.19 1.17 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.281 1.032 . . . . 10.0 112.572 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.06 -37.63 80.42 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.787 0.835 . . . . 10.0 112.644 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -59.28 -16.94 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.126 0.97 . . . . 10.0 113.392 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -102.61 -45.04 5.16 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 117.529 -1.224 . . . . 10.0 113.725 160.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.58 62.77 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.57 1.692 . . . . 10.0 115.57 -173.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.8 p -72.37 -10.39 59.72 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.869 -1.144 . . . . 10.0 113.931 171.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -154.05 24.77 0.49 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.997 1.719 . . . . 10.0 111.938 -163.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . 0.253 5.4 pt-20 . . . . . 0 C--O 1.248 1.024 0 C-N-CA 126.387 1.875 . . . . 10.0 115.233 -159.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 110.433 -1.067 . . . . 10.0 110.433 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -150.31 169.72 20.71 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.351 1.46 . . . . 10.0 110.248 -177.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.7 t -58.11 -57.11 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.845 1.258 . . . . 10.0 109.803 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.464 ' OE2' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -62.85 -39.1 93.35 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.117 1.367 . . . . 10.0 113.995 179.255 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.65 -29.79 70.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.236 -0.888 . . . . 10.0 112.345 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -89.83 -43.21 5.17 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 124.92 1.248 . . . . 10.0 112.503 -170.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.464 ' HE2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.544 -0.974 . . . . 10.0 112.606 175.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -35.81 79.59 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.09 -0.957 . . . . 10.0 112.967 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.7 tp -78.2 -33.22 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.728 1.149 . . . . 10.0 110.889 176.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -57.07 -52.9 63.42 Favored 'General case' 0 C--N 1.342 0.263 0 O-C-N 121.224 -0.923 . . . . 10.0 110.437 166.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.4 t -65.8 -9.02 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 O-C-N 121.336 -0.853 . . . . 10.0 113.166 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.96 -37.79 10.05 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.662 1.585 . . . . 10.0 112.047 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptm -124.03 -14.08 7.17 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.817 1.414 . . . . 10.0 114.817 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.5 m -119.86 -39.89 2.8 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.772 1.629 . . . . 10.0 111.725 -172.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.485 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -56.96 -20.23 22.52 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 168.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.67 -21.05 2.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.692 1.997 . . . . 10.0 113.602 168.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.0 m -143.13 -28.83 0.55 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.555 1.542 . . . . 10.0 114.759 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.46 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 91.3 m-70 -103.49 -55.73 2.34 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.591 1.33 . . . . 10.0 114.591 -169.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.485 ' H ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 m 35.11 84.35 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.593 2.757 . . . . 10.0 114.173 -168.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.63 -34.09 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.361 1.065 . . . . 10.0 112.545 164.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -95.1 154.8 17.0 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.921 0.711 . . . . 10.0 112.921 -156.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.8 mttp 50.98 -120.84 1.69 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.165 1.386 . . . . 10.0 110.485 176.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.261 0 C-N-CA 124.549 1.071 . . . . 10.0 112.405 172.713 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.46 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -129.15 172.05 19.81 Favored Glycine 0 CA--C 1.539 1.569 0 N-CA-C 109.525 -1.43 . . . . 10.0 109.525 152.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -71.65 163.58 38.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 120.286 2.043 . . . . 10.0 110.033 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -72.03 7.76 1.52 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.825 1.787 . . . . 10.0 115.825 -167.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mp 40.3 73.68 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.219 1.408 . . . . 10.0 111.587 -165.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -53.34 -164.51 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.894 2.878 . . . . 10.0 113.243 173.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.72 58.72 0.05 OUTLIER Glycine 0 CA--C 1.541 1.658 0 O-C-N 120.011 -1.681 . . . . 10.0 113.149 163.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tp -69.76 -38.47 76.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 128.679 2.792 . . . . 10.0 113.832 -161.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -66.21 95.95 0.32 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.457 1.503 . . . . 10.0 110.29 -175.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.72 13.85 9.99 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.225 1.393 . . . . 10.0 114.678 -173.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.6 ptm85 -150.64 -176.61 5.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.413 2.107 . . . . 10.0 114.74 -175.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -74.6 161.75 29.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.973 2.109 . . . . 10.0 113.837 -163.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.57 -34.74 25.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.56 1.944 . . . . 10.0 113.315 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.92 2.58 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 119.908 -1.745 . . . . 10.0 112.696 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.81 -5.01 1.05 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 118.057 2.614 . . . . 10.0 118.057 -168.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.92 113.75 27.86 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 125.807 1.643 . . . . 10.0 114.424 -167.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -79.22 57.25 6.39 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.552 3.501 . . . . 10.0 113.211 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.59 67.2 0.23 Allowed Glycine 0 N--CA 1.471 1.031 0 C-N-CA 124.527 1.061 . . . . 10.0 112.989 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -144.9 177.76 8.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.352 1.461 . . . . 10.0 109.255 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.2 t -152.77 123.85 7.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.271 1.028 . . . . 10.0 109.686 -177.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.19 172.48 18.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.492 1.517 . . . . 10.0 112.705 -159.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.4 p -74.81 107.12 6.7 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.541 -0.725 . . . . 10.0 110.902 177.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -75.21 83.35 2.38 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 122.489 1.138 . . . . 10.0 112.877 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -139.27 -46.21 0.46 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.096 1.758 . . . . 10.0 108.924 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -45.5 -67.04 0.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.373 2.269 . . . . 10.0 111.024 161.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -57.0 -49.33 76.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.265 0.939 . . . . 10.0 111.727 -178.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.69 -17.38 3.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.317 1.847 . . . . 10.0 115.012 173.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.16 60.08 0.29 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.345 0.975 . . . . 10.0 111.002 -169.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.06 -160.39 4.68 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.882 1.706 . . . . 10.0 115.527 173.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.3 pp -169.99 5.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 126.887 2.075 . . . . 10.0 112.698 -150.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.6 m 56.0 118.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.923 2.089 . . . . 10.0 113.645 -163.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -69.53 121.98 18.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.73 -1.231 . . . . 10.0 110.441 168.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -171.03 -179.05 2.63 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.349 1.859 . . . . 10.0 111.439 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -62.06 27.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 131.177 3.791 . . . . 10.0 115.46 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -160.07 9.28 0.1 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.254 2.222 . . . . 10.0 112.089 -167.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.2 p -157.71 -26.78 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.911 -1.118 . . . . 10.0 111.767 -165.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.8 -28.41 60.71 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 117.833 -1.079 . . . . 10.0 112.843 164.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -62.66 -54.3 41.5 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.684 1.129 . . . . 10.0 109.217 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 tp10 -64.07 -41.71 97.25 Favored 'General case' 0 N--CA 1.463 0.195 0 O-C-N 123.527 0.517 . . . . 10.0 110.017 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.64 -48.57 74.33 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.644 -0.693 . . . . 10.0 112.34 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -59.31 -53.96 52.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.288 1.403 . . . . 10.0 110.174 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.39 -18.63 63.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.883 1.438 . . . . 10.0 114.883 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.19 67.45 2.36 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 123.845 0.858 . . . . 10.0 111.803 -176.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.9 -63.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.576 2.851 . . . . 10.0 113.384 -164.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.56 -20.76 65.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.629 1.571 . . . . 10.0 113.473 -178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.88 -51.36 12.67 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.715 2.006 . . . . 10.0 111.275 168.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -60.35 -44.51 95.49 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.83 0.852 . . . . 10.0 112.767 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.34 133.59 20.65 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 124.005 0.922 . . . . 10.0 110.407 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.17 67.75 8.49 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.902 3.068 . . . . 10.0 113.9 -158.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -179.21 -115.31 0.46 Allowed Glycine 0 CA--C 1.524 0.617 0 C-N-CA 124.919 1.247 . . . . 10.0 110.037 167.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.254 36.9 m 67.85 155.89 0.11 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 128.989 2.915 . . . . 10.0 115.013 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mmtt -140.68 19.64 2.35 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.117 1.767 . . . . 10.0 112.601 -175.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.7 ttt -67.78 79.95 0.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.558 1.543 . . . . 10.0 111.398 166.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 71.7 mt -71.14 78.1 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 124.88 1.272 . . . . 10.0 109.87 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -164.09 -40.55 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.022 2.529 . . . . 10.0 110.501 170.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.98 -128.69 1.31 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.299 1.44 . . . . 10.0 112.945 -167.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.59 162.89 53.49 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-O 122.271 0.928 . . . . 10.0 115.131 -162.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.5 tp -80.83 3.91 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 113.757 1.021 . . . . 10.0 113.757 -168.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 62.4 0.65 0.63 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.571 2.348 . . . . 10.0 115.695 172.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -160.37 -144.97 0.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 129.983 3.313 . . . . 10.0 106.847 -163.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.64 -31.73 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 122.953 2.615 . . . . 10.0 117.888 -176.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -61.8 -34.52 76.06 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 121.604 2.002 . . . . 10.0 110.931 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.4 pm0 -75.31 -4.43 39.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.914 2.485 . . . . 10.0 114.731 170.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.4 tpm_? -72.45 -58.25 3.54 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 120.77 -1.206 . . . . 10.0 109.852 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -75.57 -29.7 59.42 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 117.076 -1.44 . . . . 10.0 114.29 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 9.6 p30 -65.06 -42.19 94.45 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.789 2.086 . . . . 10.0 112.7 177.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -55.54 -48.27 74.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.753 1.621 . . . . 10.0 112.532 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.7 mm -61.6 -48.1 90.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 118.872 -0.585 . . . . 10.0 109.642 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.3 91.07 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.638 0.775 . . . . 10.0 112.099 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -60.71 -61.93 2.23 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.846 1.258 . . . . 10.0 111.745 173.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.58 -39.73 94.64 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 118.131 -0.938 . . . . 10.0 112.029 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -16.14 63.2 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.694 1.133 . . . . 10.0 113.352 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -89.2 -58.43 2.54 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 124.24 1.016 . . . . 10.0 109.524 162.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.31 -19.1 32.18 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 115.776 1.769 . . . . 10.0 115.776 -173.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 p -65.71 -11.27 43.87 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.35 1.46 . . . . 10.0 114.589 167.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.98 -15.5 0.14 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.198 1.799 . . . . 10.0 115.028 -168.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 . . . . . 0 C--O 1.244 0.81 0 C-N-CA 126.389 1.875 . . . . 10.0 111.523 -170.132 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.988 0 CA-C-O 118.953 -0.915 . . . . 10.0 113.456 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.446 ' HB2' ' HE3' ' A' ' 5' ' ' LYS . 4.7 m-20 -135.34 139.96 44.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.651 1.58 . . . . 10.0 110.778 178.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.6 p -62.98 -43.66 99.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 -172.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.0 mp0 -61.74 -53.01 61.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.904 0.882 . . . . 10.0 110.795 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 2' ' ' ASP . 4.3 mtmp? -60.88 -20.88 62.67 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.922 1.082 . . . . 10.0 113.922 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -91.58 -38.03 5.98 Favored Glycine 0 C--N 1.337 0.62 0 CA-C-N 119.129 0.877 . . . . 10.0 112.647 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -28.51 65.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.103 1.452 . . . . 10.0 112.473 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HZ1' ' CD ' ' A' ' 90' ' ' GLU . 1.6 pttm -60.92 -50.69 72.39 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.826 0.739 . . . . 10.0 111.629 172.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -67.11 -37.16 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 118.515 0.598 . . . . 10.0 110.864 178.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.8 t80 -55.7 -52.0 65.39 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-N 118.082 0.401 . . . . 10.0 110.541 170.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.42 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.4 t -65.95 -11.67 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -95.34 -32.47 12.94 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.89 1.276 . . . . 10.0 112.638 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -122.12 -56.98 1.8 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.883 1.273 . . . . 10.0 111.333 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 12.6 m -67.1 -51.52 53.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.864 1.666 . . . . 10.0 112.6 -171.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.46 -11.03 39.2 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 -172.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.57 -56.42 21.52 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.17 1.388 . . . . 10.0 109.531 166.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.3 m -85.25 -37.43 20.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.02 1.328 . . . . 10.0 112.556 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -120.82 44.89 2.37 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 127.079 2.152 . . . . 10.0 112.973 -163.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -57.86 125.19 21.98 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 119.872 -1.768 . . . . 10.0 111.537 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.78 -38.24 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-O 117.248 -1.358 . . . . 10.0 114.518 -168.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -11.84 37.81 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 121.46 1.936 . . . . 10.0 114.605 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -152.02 152.01 31.89 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 128.221 2.608 . . . . 10.0 107.944 167.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.236 0 C-N-CA 125.07 1.319 . . . . 10.0 114.504 177.25 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.49 159.0 19.99 Favored Glycine 0 CA--C 1.545 1.914 0 CA-C-N 120.941 1.7 . . . . 10.0 112.199 164.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.73 168.87 23.38 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 125.079 3.852 . . . . 10.0 113.537 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.51 123.41 19.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.63 -1.294 . . . . 10.0 108.336 162.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.74 93.27 0.1 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.303 1.041 . . . . 10.0 109.096 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -170.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.261 3.024 . . . . 10.0 113.448 -178.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.89 53.34 0.1 OUTLIER Glycine 0 CA--C 1.541 1.698 0 C-N-CA 126.424 1.964 . . . . 10.0 114.816 172.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mp -68.63 177.58 2.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 129.594 3.158 . . . . 10.0 112.931 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 64.18 59.7 1.03 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.232 1.813 . . . . 10.0 110.504 -166.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.17 16.84 0.26 Allowed Glycine 0 CA--C 1.535 1.283 0 N-CA-C 116.725 1.45 . . . . 10.0 116.725 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.0 ptm85 -152.88 168.78 24.64 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.326 2.063 . . . . 10.0 112.969 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.75 173.86 11.16 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.472 1.909 . . . . 10.0 113.554 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 77.6 p -69.65 172.57 7.24 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.583 1.953 . . . . 10.0 111.541 159.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.35 51.24 4.45 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.201 -0.937 . . . . 10.0 114.603 171.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -11.22 2.85 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.601 1.334 . . . . 10.0 114.601 -164.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.62 140.77 92.3 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 123.35 0.66 . . . . 10.0 112.036 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.03 63.38 8.74 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.558 2.838 . . . . 10.0 112.24 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.24 64.54 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.371 0.986 . . . . 10.0 114.978 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -67.32 170.36 7.38 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 118.424 1.112 . . . . 10.0 112.115 170.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.4 t -152.72 138.35 17.81 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.075 -1.015 . . . . 10.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 -96.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.464 1.506 . . . . 10.0 111.378 -154.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.2 p -142.24 136.89 30.29 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.599 1.559 . . . . 10.0 109.74 167.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -74.75 -31.05 61.69 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.087 -0.506 . . . . 10.0 112.339 177.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.26 -29.83 70.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.505 1.922 . . . . 10.0 113.299 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -72.8 -74.77 0.16 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.48 0.712 . . . . 10.0 109.542 160.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.412 ' HZ1' ' CG ' ' A' ' 50' ' ' ASP 0.307 0.0 OUTLIER -60.24 -31.64 70.39 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.324 1.601 . . . . 10.0 115.324 -157.133 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.37 -22.89 65.55 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.876 1.435 . . . . 10.0 114.876 173.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.67 -36.29 83.22 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.582 1.083 . . . . 10.0 110.797 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.75 13.49 69.68 Favored Glycine 0 CA--C 1.533 1.165 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 165.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.4 pt -51.61 140.47 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 125.931 1.692 . . . . 10.0 111.85 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.1 m -76.13 108.53 9.11 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.418 0.628 . . . . 10.0 109.783 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -69.98 114.89 8.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.947 0.899 . . . . 10.0 111.33 173.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -163.85 -174.53 3.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.316 3.046 . . . . 10.0 109.294 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.22 -54.36 44.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.215 -0.928 . . . . 10.0 111.849 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -62.88 20.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.982 2.913 . . . . 10.0 115.467 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.4 p -158.37 -36.84 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.463 1.905 . . . . 10.0 111.228 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mp -73.92 -30.76 62.74 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 121.051 1.75 . . . . 10.0 112.642 166.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.1 ttm -64.27 -52.62 57.76 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.559 0.618 . . . . 10.0 109.487 175.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.65 -38.41 91.01 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.339 0.656 . . . . 10.0 110.647 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -64.21 -61.9 1.96 Allowed 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.451 -0.785 . . . . 10.0 112.323 175.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.0 tp -66.49 -30.11 70.37 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 120.323 1.42 . . . . 10.0 113.42 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -68.93 -24.49 64.29 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 119.01 0.823 . . . . 10.0 112.809 172.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.25 77.94 2.02 Favored Pre-proline 0 CA--C 1.556 1.208 0 N-CA-C 114.609 1.337 . . . . 10.0 114.609 172.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.79 -41.43 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 121.883 1.722 . . . . 10.0 112.143 -166.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.446 ' HE2' ' CB ' ' A' ' 83' ' ' ALA . 33.3 mttm -67.58 23.28 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.318 2.647 . . . . 10.0 114.777 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.4 mttm -161.36 -31.97 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.555 2.342 . . . . 10.0 111.932 -170.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -68.51 -31.63 71.02 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.276 0.944 . . . . 10.0 113.321 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 pt -135.81 151.84 74.82 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.889 1.276 . . . . 10.0 110.808 177.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.98 22.17 0.49 Allowed 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.29 3.326 . . . . 10.0 115.91 -159.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.4 100.47 0.17 Allowed Glycine 0 CA--C 1.524 0.638 0 O-C-N 121.206 -0.934 . . . . 10.0 112.663 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.32 -27.53 2.42 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.066 1.506 . . . . 10.0 115.066 -172.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.63 -70.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 116.566 -1.683 . . . . 10.0 112.831 -170.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.6 ttt 23.3 92.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 129.535 3.134 . . . . 10.0 113.914 -176.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.8 mt -70.31 70.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 125.741 1.616 . . . . 10.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -162.76 -70.16 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.458 1.903 . . . . 10.0 110.445 169.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.446 ' CB ' ' HE2' ' A' ' 72' ' ' LYS . . . 45.51 87.09 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.72 2.408 . . . . 10.0 116.732 171.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.65 93.63 2.26 Favored Glycine 0 C--N 1.341 0.843 0 C-N-CA 124.472 1.034 . . . . 10.0 111.181 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -66.54 156.24 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 122.34 1.067 . . . . 10.0 113.166 -175.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -59.98 -20.92 60.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.142 2.177 . . . . 10.0 115.356 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -161.51 133.84 5.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.998 2.119 . . . . 10.0 109.392 -165.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.75 -57.33 13.39 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.113 0.965 . . . . 10.0 112.79 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.4 m -50.72 -43.8 57.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.004 1.321 . . . . 10.0 112.278 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.488 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 60.0 mm-40 -59.41 -34.74 72.84 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.394 1.078 . . . . 10.0 112.734 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.471 HH21 HD12 ' A' ' 95' ' ' ILE . 1.3 ttp-105 -70.49 -34.19 72.09 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.127 1.33 . . . . 10.0 112.545 172.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.35 -46.8 72.32 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 174.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -56.57 -52.12 66.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.602 1.561 . . . . 10.0 113.408 171.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 23.3 tp -53.12 -49.44 66.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.714 1.605 . . . . 10.0 113.521 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.471 HD12 HH21 ' A' ' 91' ' ' ARG . 12.1 mt -62.12 -39.28 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-O 119.176 -0.44 . . . . 10.0 110.685 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.44 87.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.562 0.619 . . . . 10.0 112.6 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -56.22 -56.3 22.62 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 117.841 -1.076 . . . . 10.0 111.281 169.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.14 -34.46 78.44 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 120.029 1.286 . . . . 10.0 112.37 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -59.42 -25.52 64.39 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 171.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -93.75 -62.06 1.43 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.741 1.616 . . . . 10.0 112.057 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.96 -11.17 12.03 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.803 1.779 . . . . 10.0 115.803 -164.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 p -81.27 -6.6 59.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -153.56 -10.45 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.187 1.795 . . . . 10.0 114.999 -169.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.249 1.046 0 C-N-CA 127.798 2.439 . . . . 10.0 110.725 -177.413 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 119.46 -0.633 . . . . 10.0 112.002 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -136.65 132.11 34.56 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.118 0.967 . . . . 10.0 111.159 -157.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.48 -54.96 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 125.428 1.491 . . . . 10.0 111.422 -167.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.22 -27.63 66.53 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 115.565 1.691 . . . . 10.0 115.565 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -64.23 -42.6 96.49 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.337 0.517 . . . . 10.0 109.611 163.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.56 -41.98 49.34 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 124.348 0.975 . . . . 10.0 111.377 -170.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -45.17 -59.62 2.54 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 126.987 2.115 . . . . 10.0 111.287 173.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -71.89 -42.3 66.95 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.314 1.046 . . . . 10.0 112.085 -172.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.84 -37.46 79.93 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 118.767 0.712 . . . . 10.0 111.351 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -56.02 -52.24 64.93 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 119.107 0.867 . . . . 10.0 110.107 167.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.414 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.5 t -61.36 -14.33 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -92.52 -38.51 11.89 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.472 1.509 . . . . 10.0 112.169 -177.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -130.23 0.09 4.61 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.769 1.766 . . . . 10.0 115.769 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.1 m -131.8 -43.48 0.99 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.241 1.417 . . . . 10.0 112.592 -176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.64 -25.52 67.4 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.135 -0.978 . . . . 10.0 112.821 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -1.57 0.24 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.542 2.337 . . . . 10.0 114.791 170.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.3 m -143.16 -33.16 0.45 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.004 2.122 . . . . 10.0 112.468 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -115.25 -10.21 12.13 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.018 1.727 . . . . 10.0 115.271 -174.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 p 57.6 -68.17 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 128.661 2.784 . . . . 10.0 117.487 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.3 t 39.22 -96.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 128.954 2.902 . . . . 10.0 112.33 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -65.74 -17.46 64.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.472 1.109 . . . . 10.0 112.605 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -80.39 59.53 3.49 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.604 -1.31 . . . . 10.0 110.974 166.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.18 0 C-N-CA 126.1 1.81 . . . . 10.0 114.633 173.856 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.373 0.508 . . . . 10.0 112.373 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -132.8 173.86 20.74 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 125.583 1.563 . . . . 10.0 110.286 162.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.476 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 84.8 Cg_endo -72.21 161.22 45.17 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.36 2.04 . . . . 10.0 110.609 172.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.96 125.08 23.78 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.985 -1.072 . . . . 10.0 109.711 166.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -77.34 74.76 3.9 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 163.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -170.83 0.14 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 10.0 109.503 158.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -32.45 114.44 0.08 OUTLIER Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.13 0.871 . . . . 10.0 112.421 163.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 tp -136.56 -46.79 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.462 1.505 . . . . 10.0 112.054 -174.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.592 ' HB2' HG21 ' A' ' 102' ' ' THR . 2.5 m-85 -71.0 109.58 5.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.434 0.693 . . . . 10.0 109.953 -168.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.25 4.29 90.25 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 118.661 -1.077 . . . . 10.0 113.865 -174.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mtp85 -81.45 -97.28 0.04 OUTLIER 'General case' 0 C--N 1.347 0.478 0 CA-C-O 116.946 -1.502 . . . . 10.0 109.087 169.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -152.42 -119.95 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 120.578 1.536 . . . . 10.0 110.744 174.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.6 m -148.7 165.85 30.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.468 3.107 . . . . 10.0 106.967 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 68.46 -3.58 5.95 Favored Glycine 0 CA--C 1.529 0.917 0 N-CA-C 118.763 2.265 . . . . 10.0 118.763 156.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.23 125.38 26.5 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.603 1.961 . . . . 10.0 111.236 174.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.71 157.38 16.33 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.88 1.672 . . . . 10.0 108.732 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -83.84 -119.24 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 124.005 3.137 . . . . 10.0 109.897 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.99 74.8 0.95 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.915 1.245 . . . . 10.0 113.084 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.476 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 51.0 t80 -144.56 107.24 4.43 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.019 1.327 . . . . 10.0 111.791 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.5 m -79.77 95.32 5.96 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.773 1.229 . . . . 10.0 111.539 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.05 173.19 11.32 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.356 0.872 . . . . 10.0 113.356 169.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.4 p -69.31 -5.05 20.66 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 128.66 2.784 . . . . 10.0 115.616 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 t70 47.42 -169.46 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.384 1.874 . . . . 10.0 114.046 -159.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.23 -42.82 0.1 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.374 3.07 . . . . 10.0 115.307 -166.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -61.29 2.72 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.838 1.255 . . . . 10.0 111.079 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -43.23 55.18 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 127.315 2.246 . . . . 10.0 112.375 168.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -18.22 65.19 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 115.447 1.647 . . . . 10.0 115.447 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.96 -32.29 61.68 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.093 0.86 . . . . 10.0 111.174 170.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.17 28.43 73.68 Favored Glycine 0 CA--C 1.537 1.466 0 N-CA-C 116.277 1.271 . . . . 10.0 116.277 162.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -7.55 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 127.343 2.257 . . . . 10.0 116.584 -173.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.4 m 57.62 108.47 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.695 2.398 . . . . 10.0 114.384 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -66.62 135.07 53.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.18 1.392 . . . . 10.0 110.624 172.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 163.23 -72.5 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 129.875 3.27 . . . . 10.0 107.692 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -44.82 -61.77 1.47 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.548 1.939 . . . . 10.0 111.477 -178.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 2.3 p -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 127.611 2.364 . . . . 10.0 112.22 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -32.92 60.23 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.105 0.962 . . . . 10.0 113.449 177.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 6.8 ttm -62.83 -52.9 61.35 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 170.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -64.97 -38.19 90.15 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.226 1.41 . . . . 10.0 111.025 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -60.83 -64.09 1.08 Allowed 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.208 1.003 . . . . 10.0 110.716 170.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.72 -32.15 68.94 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.611 1.096 . . . . 10.0 112.67 -175.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.4 -35.33 69.89 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.669 1.359 . . . . 10.0 114.669 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -162.39 80.49 1.81 Allowed Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 119.811 1.187 . . . . 10.0 111.543 173.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.7 -44.68 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.413 2.076 . . . . 10.0 112.174 -160.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -60.14 -34.78 74.02 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 127.209 2.204 . . . . 10.0 113.359 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -76.3 -41.41 48.71 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 119.061 -0.495 . . . . 10.0 111.489 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -69.88 -39.25 76.4 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.649 1.351 . . . . 10.0 114.649 -171.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 21.0 pt -135.17 144.02 48.25 Favored Pre-proline 0 N--CA 1.473 0.696 0 CA-C-N 118.811 0.732 . . . . 10.0 111.458 172.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -69.3 163.87 36.28 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.192 2.594 . . . . 10.0 111.083 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.15 -22.82 0.16 Allowed Glycine 0 CA--C 1.535 1.323 0 N-CA-C 116.344 1.298 . . . . 10.0 116.344 176.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.73 118.63 5.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 120.053 1.926 . . . . 10.0 109.745 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -87.12 -71.08 0.58 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.871 0.868 . . . . 10.0 110.683 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.4 ttp 28.61 101.17 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 129.892 3.277 . . . . 10.0 113.987 -176.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.6 tp -64.2 54.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 128.871 2.868 . . . . 10.0 114.407 -174.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -163.4 -176.08 4.56 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.542 2.337 . . . . 10.0 110.697 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.51 -155.82 0.34 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.867 2.467 . . . . 10.0 109.763 -173.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.68 44.06 0.15 Allowed Glycine 0 CA--C 1.536 1.354 0 C-N-CA 128.193 2.806 . . . . 10.0 117.656 -170.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.442 HG23 ' H ' ' A' ' 86' ' ' LYS 0.368 7.4 tt 42.96 -112.19 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 128.833 2.853 . . . . 10.0 113.036 -177.45 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.442 ' H ' HG23 ' A' ' 85' ' ' ILE . 53.9 tttm -149.7 -69.65 0.2 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.157 1.799 . . . . 10.0 113.259 173.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.474 ' HE3' ' H ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -76.74 148.04 36.96 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.486 1.039 . . . . 10.0 110.684 173.255 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -58.55 -36.84 74.52 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.11 -0.369 . . . . 10.0 111.619 169.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 m -55.94 -53.81 52.3 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 124.774 1.23 . . . . 10.0 110.062 176.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -57.76 -39.4 77.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.832 0.853 . . . . 10.0 111.771 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -59.2 -50.51 73.76 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 118.764 -0.636 . . . . 10.0 111.709 175.109 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -58.19 -52.63 64.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.392 1.077 . . . . 10.0 111.539 172.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -55.81 -47.78 76.56 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 126.841 2.056 . . . . 10.0 111.465 -170.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.56 -43.8 93.48 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.4 mm -65.45 -44.26 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 118.948 -0.549 . . . . 10.0 110.528 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.38 85.74 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.649 0.779 . . . . 10.0 112.163 175.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.403 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 1.1 t80 -57.21 -55.07 39.54 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.061 1.344 . . . . 10.0 111.443 171.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 22.6 mt -63.29 -34.7 78.25 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 118.436 -0.792 . . . . 10.0 112.618 -177.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -59.98 -20.79 59.54 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.941 1.296 . . . . 10.0 113.462 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -92.87 -50.68 5.44 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.73 1.212 . . . . 10.0 112.196 165.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.04 -22.85 63.17 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 120.21 1.368 . . . . 10.0 114.567 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 36' ' ' PHE . 14.6 t -76.55 6.4 5.89 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.586 1.954 . . . . 10.0 114.489 169.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -151.37 -42.35 0.12 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.855 1.662 . . . . 10.0 113.685 -166.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 115.987 -1.959 . . . . 10.0 115.224 -179.184 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.608 -1.106 . . . . 10.0 113.51 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -118.12 154.5 32.02 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.776 1.63 . . . . 10.0 112.143 166.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.92 -52.15 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.21 1.404 . . . . 10.0 111.886 171.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -47.36 71.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 124.277 1.031 . . . . 10.0 113.469 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.58 -15.66 58.72 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.961 0.8 . . . . 10.0 112.204 172.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.21 -48.96 3.4 Favored Glycine 0 C--N 1.34 0.773 0 C-N-CA 125.224 1.393 . . . . 10.0 112.318 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.416 ' HB3' ' CD1' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -63.88 -35.12 79.6 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 122.264 -0.55 . . . . 10.0 112.478 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -39.18 90.01 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.441 0.904 . . . . 10.0 113.441 174.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -33.89 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.615 1.098 . . . . 10.0 111.079 175.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -55.98 -52.07 65.49 Favored 'General case' 0 C--N 1.342 0.244 0 O-C-N 121.435 -0.791 . . . . 10.0 110.454 167.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.9 t -63.67 -11.41 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 113.632 0.975 . . . . 10.0 113.632 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -85.32 -48.0 9.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.271 1.028 . . . . 10.0 111.337 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -136.07 4.85 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 -168.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.5 m -116.74 -41.6 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.439 1.496 . . . . 10.0 111.215 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.64 -27.07 57.66 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.538 0.94 . . . . 10.0 113.538 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -55.34 -15.21 2.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.882 2.073 . . . . 10.0 115.571 172.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 69.4 m -142.09 -14.32 0.8 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.237 1.415 . . . . 10.0 112.673 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -128.44 -13.45 4.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.845 1.424 . . . . 10.0 114.845 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.3 t 39.46 11.62 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 120.352 3.464 . . . . 10.0 120.352 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.0 p -63.82 -16.02 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 N-CA-C 117.053 2.242 . . . . 10.0 117.053 -160.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.03 6.83 4.71 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.251 1.387 . . . . 10.0 112.443 169.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -152.02 -173.26 4.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.188 2.995 . . . . 10.0 107.941 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.168 0 O-C-N 121.057 -1.027 . . . . 10.0 112.113 179.472 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -134.68 148.46 19.53 Favored Glycine 0 CA--C 1.547 2.065 0 CA-C-N 121.902 2.137 . . . . 10.0 113.724 165.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -82.27 68.08 7.89 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.064 3.176 . . . . 10.0 112.395 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 p30 47.73 -11.46 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.495 1 N-CA-C 122.121 4.119 . . . . 10.0 122.121 157.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . 0.315 5.0 mp 55.28 37.37 28.8 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 128.755 2.822 . . . . 10.0 117.158 -175.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.67 108.22 0.29 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.945 1.698 . . . . 10.0 113.954 164.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.27 35.17 49.42 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 116.187 1.235 . . . . 10.0 116.187 158.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.78 -175.85 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 126.505 1.922 . . . . 10.0 111.696 168.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 60.39 64.97 1.12 Allowed 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.336 -1.478 . . . . 10.0 112.855 -173.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.59 -35.28 2.51 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.591 2.043 . . . . 10.0 112.886 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.544 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -66.79 154.41 40.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.335 1.054 . . . . 10.0 110.488 169.469 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -62.87 177.97 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.875 1.67 . . . . 10.0 111.963 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.71 156.17 31.25 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.12 -0.988 . . . . 10.0 109.731 158.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.44 -116.21 4.35 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.249 -0.907 . . . . 10.0 112.926 169.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 54.64 -7.38 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.268 2.227 . . . . 10.0 116.766 -172.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.42 158.59 10.51 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.327 2.651 . . . . 10.0 113.349 176.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.53 -175.25 1.04 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.144 2.562 . . . . 10.0 111.002 161.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.99 28.36 0.07 OUTLIER Glycine 0 CA--C 1.541 1.688 0 C-N-CA 127.492 2.472 . . . . 10.0 118.015 -173.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.27 128.06 34.16 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.917 1.687 . . . . 10.0 109.707 166.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 m -73.46 125.04 27.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.175 0.99 . . . . 10.0 112.489 -174.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.08 178.15 7.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.536 1.934 . . . . 10.0 112.572 -175.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.0 p -85.93 106.24 16.98 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.169 0.895 . . . . 10.0 110.856 166.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -56.29 -29.49 61.25 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.863 1.801 . . . . 10.0 115.863 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.82 -54.94 31.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.87 1.268 . . . . 10.0 112.094 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -47.27 -55.98 7.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.746 1.618 . . . . 10.0 111.82 174.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.412 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -57.0 -57.25 13.35 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.571 0.748 . . . . 10.0 110.924 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -65.6 -22.74 66.7 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.489 0.922 . . . . 10.0 113.489 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -20.99 66.38 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.135 0.88 . . . . 10.0 112.858 171.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.06 11.58 63.89 Favored Glycine 0 CA--C 1.535 1.336 0 N-CA-C 116.076 1.191 . . . . 10.0 116.076 164.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.28 -6.29 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 128.643 2.777 . . . . 10.0 117.236 -171.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 84.9 m 58.38 117.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.65 2.78 . . . . 10.0 115.665 171.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 21.6 m95 -76.0 120.73 21.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.861 -1.063 . . . . 10.0 112.644 -175.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.37 179.21 5.12 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.262 2.225 . . . . 10.0 110.605 -176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.75 -13.24 62.18 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.248 1.419 . . . . 10.0 114.754 -169.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.02 -58.61 3.18 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.505 1.145 . . . . 10.0 111.406 163.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.6 p -75.19 -37.32 61.25 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.728 1.611 . . . . 10.0 112.882 -165.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.02 -11.71 59.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.965 1.306 . . . . 10.0 113.938 172.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -65.95 0.61 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 106.878 -1.527 . . . . 10.0 106.878 158.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -45.53 70.56 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.431 1.092 . . . . 10.0 111.332 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -66.64 -56.05 12.46 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.463 0.912 . . . . 10.0 113.463 -177.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -27.5 65.62 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.584 1.538 . . . . 10.0 112.36 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -66.55 -38.06 86.31 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 120.197 1.362 . . . . 10.0 114.227 169.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -162.81 100.13 1.06 Allowed Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 119.885 1.221 . . . . 10.0 111.672 166.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.435 ' HB2' HG21 ' A' ' 78' ' ' THR . 58.3 Cg_endo -71.69 -46.48 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.271 1.981 . . . . 10.0 111.493 -168.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -70.03 -22.36 63.1 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.224 1.81 . . . . 10.0 113.293 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -72.44 -53.93 10.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.716 0.806 . . . . 10.0 110.43 163.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -58.99 -41.0 86.54 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.42 155.27 64.28 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 124.228 1.011 . . . . 10.0 111.852 170.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.36 150.6 52.78 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.56 2.173 . . . . 10.0 113.193 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.87 -100.44 2.52 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.089 2.28 . . . . 10.0 111.208 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 71' ' ' PRO 0.289 96.9 m 34.65 90.43 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 130.731 3.612 . . . . 10.0 116.058 -176.075 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -73.31 19.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.853 1.427 . . . . 10.0 114.853 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.5 ttt -70.29 78.16 0.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.158 -0.964 . . . . 10.0 108.932 164.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 25.9 mm -69.51 78.56 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 125.0 1.32 . . . . 10.0 109.654 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -162.73 -72.42 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.52 1.128 . . . . 10.0 111.935 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -70.6 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.268 2.627 . . . . 10.0 116.439 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.17 86.78 0.11 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 126.621 2.058 . . . . 10.0 113.828 -166.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.406 ' CD1' HD22 ' A' ' 94' ' ' LEU . 21.1 tt -63.28 -53.99 38.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 115.108 1.521 . . . . 10.0 115.108 -163.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 163.58 -169.8 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 1 C-N-CA 131.821 4.049 . . . . 10.0 109.138 -175.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.435 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.64 -70.21 0.11 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.924 2.489 . . . . 10.0 114.207 -162.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.71 -51.5 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.502 1.297 . . . . 10.0 114.502 -173.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -46.87 88.26 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.439 1.018 . . . . 10.0 110.525 -175.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -60.27 -33.71 72.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.937 1.695 . . . . 10.0 112.179 -172.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.9 -43.94 97.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.009 2.124 . . . . 10.0 112.476 172.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.71 -43.44 65.9 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.896 1.278 . . . . 10.0 110.565 174.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -58.24 -44.09 88.13 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.689 1.196 . . . . 10.0 110.376 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.406 HD22 ' CD1' ' A' ' 85' ' ' ILE . 1.0 OUTLIER -52.61 -47.63 66.85 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.229 1.196 . . . . 10.0 114.229 171.567 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.94 -47.22 89.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.62 82.16 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.648 0.779 . . . . 10.0 112.319 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.416 ' CD1' ' HB3' ' A' ' 7' ' ' LYS . 3.6 t80 -65.01 -63.23 1.16 Allowed 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.611 1.164 . . . . 10.0 112.017 171.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.43 -33.27 75.56 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.262 -0.875 . . . . 10.0 112.419 -170.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.55 -14.48 42.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.642 1.177 . . . . 10.0 113.311 172.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -95.29 -58.95 2.0 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.421 1.089 . . . . 10.0 110.952 161.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.81 -16.63 17.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 116.429 2.011 . . . . 10.0 116.429 -168.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.5 p -74.96 -4.54 38.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.844 1.424 . . . . 10.0 114.844 168.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -153.32 -22.24 0.15 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.062 1.745 . . . . 10.0 114.465 -167.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 C--O 1.249 1.035 0 C-N-CA 126.872 2.069 . . . . 10.0 111.059 -160.933 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.667 0 CA-C-O 118.924 -0.931 . . . . 10.0 112.326 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.07 140.93 36.22 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.087 0.944 . . . . 10.0 112.816 -149.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.436 HG11 ' HG3' ' A' ' 100' ' ' LYS . 0.1 OUTLIER -55.35 -50.05 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.837 2.055 . . . . 10.0 113.223 178.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mp0 -64.44 -32.94 74.77 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.373 -0.829 . . . . 10.0 111.639 -174.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -76.02 -12.38 60.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.031 1.732 . . . . 10.0 112.842 172.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.75 -48.01 3.53 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 124.21 0.91 . . . . 10.0 111.269 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -49.98 -44.34 50.79 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.161 0.98 . . . . 10.0 112.831 174.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.432 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -67.26 -12.86 61.21 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.883 1.673 . . . . 10.0 114.328 -177.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.432 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 8.1 tp -114.78 -28.03 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.689 0.796 . . . . 10.0 112.204 174.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -55.58 -52.91 62.17 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.224 1.01 . . . . 10.0 110.456 163.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.33 -12.8 9.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.936 0.717 . . . . 10.0 112.936 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.25 -70.23 0.72 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.919 1.288 . . . . 10.0 109.43 172.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -80.48 -11.14 59.71 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.228 1.566 . . . . 10.0 115.228 -168.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 m -124.46 -48.13 1.83 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.649 1.179 . . . . 10.0 111.735 -171.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.31 -13.2 57.94 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.658 0.985 . . . . 10.0 113.658 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -55.35 -14.15 1.74 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.858 1.663 . . . . 10.0 114.143 162.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.3 m -142.74 -25.03 0.63 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.803 2.041 . . . . 10.0 113.134 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.431 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 81.9 m-70 -126.74 77.17 1.7 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 127.145 2.178 . . . . 10.0 112.154 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 t -75.17 46.52 0.32 Allowed 'General case' 0 CA--C 1.557 1.249 0 O-C-N 120.182 -1.574 . . . . 10.0 114.494 -175.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.72 -51.46 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.802 1.641 . . . . 10.0 113.218 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -53.42 -45.26 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.719 1.208 . . . . 10.0 111.52 -171.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -86.17 7.24 25.8 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.63 1.572 . . . . 10.0 113.198 -176.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.08 0 C-N-CA 124.535 1.064 . . . . 10.0 114.521 175.411 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.72 167.36 16.32 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 123.835 0.731 . . . . 10.0 111.904 169.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 45.7 Cg_endo -68.3 166.3 25.81 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.27 3.313 . . . . 10.0 110.921 169.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -85.19 139.97 31.26 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.664 -1.235 . . . . 10.0 107.664 164.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.7 74.8 5.22 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.587 -0.894 . . . . 10.0 108.587 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 73.66 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.557 3.143 . . . . 10.0 113.159 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.27 -68.73 0.06 OUTLIER Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.506 2.479 . . . . 10.0 111.443 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.451 ' C ' HH11 ' A' ' 38' ' ' ARG 0.288 6.9 tp 112.06 -122.79 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.483 1 C-N-CA 132.529 4.331 . . . . 10.0 109.322 167.002 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 72.0 m-85 32.72 64.81 0.25 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.731 2.412 . . . . 10.0 116.731 167.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.25 -42.24 1.73 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.915 2.198 . . . . 10.0 115.023 172.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.451 HH11 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -64.62 11.0 0.06 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 120.363 3.468 . . . . 10.0 120.363 -158.567 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.9 mttt 79.03 147.2 0.09 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.527 3.131 . . . . 10.0 113.379 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -71.78 -40.65 69.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.605 1.562 . . . . 10.0 111.949 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.0 56.66 1.43 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 126.223 1.868 . . . . 10.0 113.251 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -129.95 -22.75 2.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 -173.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.18 105.13 0.48 Allowed Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 126.067 1.747 . . . . 10.0 113.538 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -79.97 62.32 8.48 Favored 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.11 3.207 . . . . 10.0 114.085 -163.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.13 60.63 0.18 Allowed Glycine 0 N--CA 1.471 1.027 0 C-N-CA 124.891 1.234 . . . . 10.0 112.341 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -143.63 170.75 15.25 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.545 1.538 . . . . 10.0 109.748 -169.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.6 t -152.84 153.6 33.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 122.08 0.943 . . . . 10.0 110.946 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -155.26 -105.14 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.737 -1.119 . . . . 10.0 110.369 -150.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 50.3 p -141.78 9.44 1.97 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.352 1.061 . . . . 10.0 112.859 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 48.95 -50.14 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.553 3.141 . . . . 10.0 115.009 -159.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.47 -41.22 9.24 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.725 2.01 . . . . 10.0 113.192 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -48.57 -60.9 2.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.514 1.526 . . . . 10.0 112.843 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -75.35 -33.7 61.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.171 0.988 . . . . 10.0 112.12 179.082 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.71 -32.8 74.34 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.429 1.092 . . . . 10.0 113.488 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -50.58 73.51 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.898 0.772 . . . . 10.0 110.357 172.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.84 128.54 0.55 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 123.46 0.553 . . . . 10.0 113.59 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.411 HD13 ' CE2' ' A' ' 59' ' ' TRP . 0.9 OUTLIER -170.71 13.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 126.952 2.101 . . . . 10.0 112.375 -162.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.6 m 44.92 56.58 5.23 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.303 1.441 . . . . 10.0 114.238 152.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.411 ' CE2' HD13 ' A' ' 57' ' ' ILE . 40.3 m95 -52.43 135.82 32.73 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -163.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 15.2 pttp -177.72 -167.47 0.15 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 130.702 3.601 . . . . 10.0 110.579 -168.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -68.74 32.81 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.301 2.641 . . . . 10.0 116.713 -159.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.21 -57.67 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.392 -1.442 . . . . 10.0 111.784 -169.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.4 p -53.63 -44.54 69.62 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 130.942 3.697 . . . . 10.0 111.479 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.9 mp -65.18 -32.98 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.436 1.016 . . . . 10.0 113.37 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.9 mtm -75.24 -25.99 58.53 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 120.116 1.325 . . . . 10.0 111.84 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -75.52 -47.58 26.3 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 118.929 0.786 . . . . 10.0 111.708 162.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.68 -43.33 89.61 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 114.009 1.114 . . . . 10.0 114.009 -173.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -64.36 -41.35 96.78 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.326 1.421 . . . . 10.0 111.68 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -68.6 -28.76 67.21 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.902 1.075 . . . . 10.0 113.902 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -161.34 86.88 1.66 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.731 1.212 . . . . 10.0 111.276 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.07 -48.17 5.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.355 2.037 . . . . 10.0 113.694 -169.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -69.98 -19.36 63.35 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.177 1.391 . . . . 10.0 113.036 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.38 -47.75 46.97 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.493 1.117 . . . . 10.0 110.191 167.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -71.98 -40.75 68.35 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.643 0.979 . . . . 10.0 113.643 -174.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.0 pt -135.79 126.7 16.98 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.345 1.058 . . . . 10.0 109.324 170.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -70.77 148.84 59.41 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.455 2.103 . . . . 10.0 111.261 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 47.37 66.75 1.76 Allowed Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.066 1.317 . . . . 10.0 113.124 176.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.2 t -123.61 23.27 8.89 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.216 1.406 . . . . 10.0 113.918 -169.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt 47.83 -88.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.181 2.192 . . . . 10.0 113.631 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt 15.21 90.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 131.019 3.728 . . . . 10.0 113.82 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.515 ' H ' HD12 ' A' ' 81' ' ' ILE . 2.6 mp -74.52 54.89 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 126.733 2.013 . . . . 10.0 110.139 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -163.28 66.63 0.19 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.411 1.885 . . . . 10.0 109.709 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.39 112.19 11.45 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.157 0.983 . . . . 10.0 110.408 172.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.26 175.13 32.99 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.766 1.204 . . . . 10.0 113.612 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -143.92 149.47 17.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.317 -1.364 . . . . 10.0 107.317 157.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -66.83 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.277 1.031 . . . . 10.0 113.185 -166.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -77.05 120.99 22.92 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.037 -1.097 . . . . 10.0 108.037 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -63.66 -16.46 61.04 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.073 1.306 . . . . 10.0 113.999 -174.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 m -55.48 -34.94 65.0 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.948 . . . . 10.0 112.421 163.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.19 -38.63 88.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.97 1.308 . . . . 10.0 111.181 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -60.87 -50.71 72.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.626 1.17 . . . . 10.0 110.938 175.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.56 -53.16 61.52 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.459 1.103 . . . . 10.0 111.886 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -56.66 -44.09 81.02 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.315 1.446 . . . . 10.0 110.617 -175.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mp -60.32 -45.65 92.65 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.189 1.181 . . . . 10.0 114.189 175.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mm -61.04 -48.59 88.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.91 73.68 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.76 0.424 . . . . 10.0 111.549 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.402 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.1 t80 -51.46 -59.1 4.62 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.792 1.637 . . . . 10.0 112.754 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.402 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 48.1 mt -68.45 -36.08 78.51 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.224 0.92 . . . . 10.0 112.15 -178.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -32.46 74.02 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.654 0.661 . . . . 10.0 112.302 178.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HG3' HG11 ' A' ' 3' ' ' VAL . 3.0 mmmp? -72.8 -52.6 14.3 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.333 1.453 . . . . 10.0 112.242 165.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.79 -27.98 45.59 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.898 1.444 . . . . 10.0 114.898 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.6 t -76.49 2.78 12.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 115.643 1.719 . . . . 10.0 115.643 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -151.32 -1.84 0.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.026 1.491 . . . . 10.0 115.026 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 127.525 2.33 . . . . 10.0 114.488 175.669 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.179 -0.768 . . . . 10.0 111.179 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.53 135.16 49.96 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.423 0.689 . . . . 10.0 112.645 -155.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.28 -50.61 70.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 125.749 1.62 . . . . 10.0 111.438 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.83 -40.1 87.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.681 1.592 . . . . 10.0 114.084 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.79 -26.48 68.37 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.751 0.82 . . . . 10.0 112.514 169.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.54 -52.02 4.64 Favored Glycine 0 C--N 1.335 0.499 0 N-CA-C 110.281 -1.128 . . . . 10.0 110.281 -178.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.23 38.7 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.769 2.027 . . . . 10.0 114.709 176.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -42.16 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.713 2.405 . . . . 10.0 110.988 175.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 tp -74.83 -33.96 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 119.796 1.18 . . . . 10.0 111.426 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -56.25 -51.12 69.29 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-O 121.25 0.548 . . . . 10.0 109.889 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.7 t -65.19 -9.43 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.543 0.737 . . . . 10.0 112.539 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -94.56 -58.59 2.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.436 1.494 . . . . 10.0 111.038 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -116.99 8.74 13.49 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 116.236 1.939 . . . . 10.0 116.236 -168.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.8 m -118.81 -46.55 2.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.074 1.35 . . . . 10.0 110.842 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.02 62.58 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.05 1.13 . . . . 10.0 114.05 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.28 -12.12 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.757 1.223 . . . . 10.0 114.146 165.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.8 m -143.22 -17.57 0.65 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.083 1.753 . . . . 10.0 114.091 -176.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -132.51 102.07 5.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.699 2.0 . . . . 10.0 112.731 -175.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -67.15 24.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 128.988 2.915 . . . . 10.0 116.943 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.8 p -64.58 -39.33 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 120.404 -1.435 . . . . 10.0 114.483 -168.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -59.9 -14.45 15.53 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.011 1.724 . . . . 10.0 115.064 -160.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -150.31 13.05 0.75 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.1 2.16 . . . . 10.0 110.83 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.382 0 C-N-CA 125.74 1.638 . . . . 10.0 113.92 -168.309 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.1 m . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.977 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.69 -174.28 25.82 Favored Glycine 0 CA--C 1.541 1.71 0 N-CA-C 110.402 -1.079 . . . . 10.0 110.402 150.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -65.92 173.83 6.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.639 2.226 . . . . 10.0 110.267 168.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.532 HD21 ' CD2' ' A' ' 33' ' ' HIS . 13.7 p30 -74.01 0.71 12.8 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.391 1.477 . . . . 10.0 112.87 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.47 28.23 15.16 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.429 2.292 . . . . 10.0 114.77 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.532 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -53.74 157.42 2.31 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.826 1.25 . . . . 10.0 112.613 168.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.23 8.69 3.62 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 127.821 2.629 . . . . 10.0 118.787 149.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.436 ' CD2' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -73.17 -173.86 1.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.603 1.702 . . . . 10.0 114.001 -177.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 60.58 48.39 7.47 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.813 1.645 . . . . 10.0 110.367 -152.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 146.06 -17.38 1.74 Allowed Glycine 0 CA--C 1.545 1.927 0 N-CA-C 117.921 1.928 . . . . 10.0 117.921 176.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.436 ' NH1' ' CD2' ' A' ' 35' ' ' LEU . 16.2 ttp180 -63.58 3.92 0.3 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.708 2.484 . . . . 10.0 117.708 -165.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.279 0.0 OUTLIER 70.58 -0.76 2.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.944 2.497 . . . . 10.0 116.615 -170.185 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.293 13.8 t 52.47 -43.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 129.585 3.154 . . . . 10.0 116.217 -165.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.85 76.23 0.01 OUTLIER Glycine 0 CA--C 1.534 1.221 0 C-N-CA 126.468 1.985 . . . . 10.0 112.828 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -168.1 123.0 0.97 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.327 2.251 . . . . 10.0 111.203 -175.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.92 119.02 0.97 Allowed Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.149 1.379 . . . . 10.0 109.394 169.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 69.5 2.9 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.678 2.919 . . . . 10.0 112.134 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.12 75.59 1.25 Allowed Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.215 1.864 . . . . 10.0 112.962 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -146.56 179.88 7.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.442 1.497 . . . . 10.0 109.658 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 94.2 m -154.79 88.76 1.2 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.737 1.215 . . . . 10.0 108.838 171.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.485 1.514 . . . . 10.0 110.87 169.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 52.4 p -75.19 71.46 2.22 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.149 0.98 . . . . 10.0 110.909 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -55.97 -12.87 1.57 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.215 2.206 . . . . 10.0 116.112 -161.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.33 -26.65 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.452 -1.405 . . . . 10.0 113.141 165.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.476 ' HB2' HD12 ' A' ' 75' ' ' ILE . 17.2 p30 -78.14 -67.86 0.69 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.345 1.979 . . . . 10.0 116.345 159.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.51 -39.27 48.15 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.134 1.333 . . . . 10.0 113.248 -174.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -19.99 65.5 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.445 1.498 . . . . 10.0 114.043 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -66.92 -27.34 67.41 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.928 1.695 . . . . 10.0 111.648 168.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.79 12.13 64.1 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 115.619 1.007 . . . . 10.0 115.619 168.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -53.82 -10.17 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 127.655 2.382 . . . . 10.0 115.882 -174.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 88.8 m 57.38 128.61 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 130.122 3.369 . . . . 10.0 115.511 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -75.76 145.8 40.51 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.18 -0.918 . . . . 10.0 112.973 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 175.33 175.18 0.23 Allowed 'General case' 0 CA--C 1.538 0.487 1 C-N-CA 133.33 4.652 . . . . 10.0 106.035 -179.421 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.79 -30.39 22.83 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.517 1.302 . . . . 10.0 114.517 177.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -75.43 5.65 5.54 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.978 2.214 . . . . 10.0 116.978 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.2 p -160.53 -31.07 0.06 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.968 1.307 . . . . 10.0 111.706 -171.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 -19.67 58.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.5 1.046 . . . . 10.0 112.468 171.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -60.82 3.19 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 162.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -53.4 -45.71 69.41 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 127.741 2.416 . . . . 10.0 110.124 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CE1' HD11 ' A' ' 75' ' ' ILE . 70.6 t80 -73.47 -46.91 45.34 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 117.867 -1.063 . . . . 10.0 113.371 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.24 -39.78 95.6 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.969 1.713 . . . . 10.0 111.699 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -65.16 -32.5 74.22 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.578 1.081 . . . . 10.0 113.411 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.15 77.05 1.82 Allowed Pre-proline 0 CA--C 1.558 1.271 0 CA-C-N 119.858 1.208 . . . . 10.0 111.802 -175.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.14 -54.81 0.35 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.112 1.875 . . . . 10.0 112.905 -160.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -64.58 -23.03 67.13 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.322 1.849 . . . . 10.0 113.596 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -77.21 -47.44 20.22 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.622 1.169 . . . . 10.0 111.758 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.89 -45.0 94.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 178.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 52' ' ' ASN . 6.1 pt -136.65 145.94 53.32 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.838 0.855 . . . . 10.0 111.697 176.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.76 161.04 40.04 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 122.994 2.463 . . . . 10.0 113.266 -168.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.22 -25.16 0.26 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 126.328 1.918 . . . . 10.0 116.84 171.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.8 m -36.68 115.63 0.38 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.18 2.592 . . . . 10.0 114.674 -165.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -86.44 6.66 29.26 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.088 1.514 . . . . 10.0 115.088 177.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.4 ttt -60.4 92.13 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.625 -0.672 . . . . 10.0 109.416 158.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.2 tt -68.06 -17.84 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 122.7 1.238 . . . . 10.0 113.656 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -75.28 78.45 2.38 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.366 2.266 . . . . 10.0 110.728 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.08 59.79 0.18 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.786 1.634 . . . . 10.0 113.193 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.9 -166.12 29.8 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.456 1.503 . . . . 10.0 113.955 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -142.07 155.64 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.951 1.301 . . . . 10.0 109.439 -171.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -67.37 -78.4 0.06 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.158 1.783 . . . . 10.0 113.793 -153.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -76.43 106.75 8.24 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.51 -12.09 2.45 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 116.556 2.058 . . . . 10.0 116.556 -167.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 m -57.68 -40.28 79.05 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.269 1.428 . . . . 10.0 112.798 161.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.88 -35.27 66.32 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.458 1.503 . . . . 10.0 110.863 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.84 2.58 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.59 1.956 . . . . 10.0 114.312 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.491 ' HA ' ' H ' ' A' ' 95' ' ' ILE . 7.3 pt-20 -157.18 -5.4 0.1 Allowed 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.043 1.337 . . . . 10.0 113.5 -174.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -57.21 -47.67 80.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 140.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.58 -49.47 72.64 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.71 1.604 . . . . 10.0 114.577 170.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.491 ' H ' ' HA ' ' A' ' 92' ' ' GLU . 11.2 mm -60.0 -46.43 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.54 83.83 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.184 0.994 . . . . 10.0 112.423 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -58.7 7.39 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.657 1.183 . . . . 10.0 112.083 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.88 -31.6 72.63 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.038 0.836 . . . . 10.0 112.799 -174.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -64.29 -17.98 64.15 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.483 0.92 . . . . 10.0 113.483 173.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -92.32 -56.17 3.14 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.568 -1.206 . . . . 10.0 110.273 163.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.12 32.96 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.58 1.696 . . . . 10.0 115.58 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.4 t -68.21 -19.01 64.73 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.692 1.368 . . . . 10.0 114.692 168.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.34 -0.78 0.23 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 116.467 2.025 . . . . 10.0 116.467 -166.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 126.8 2.04 . . . . 10.0 110.611 -171.28 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 110.429 -1.068 . . . . 10.0 110.429 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.96 148.01 44.67 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.327 1.851 . . . . 10.0 112.676 -171.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.03 -38.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 121.625 -0.672 . . . . 10.0 111.581 172.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 4.7 mp0 -57.16 -44.67 83.68 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.1 1.148 . . . . 10.0 114.1 173.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -63.84 -33.47 75.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 117.86 0.3 . . . . 10.0 110.639 173.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.03 -41.68 31.64 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.302 1.429 . . . . 10.0 111.178 -172.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' A' ' 4' ' ' GLU . 30.7 pttt -69.21 -36.17 76.97 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 118.297 1.049 . . . . 10.0 111.96 174.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.81 -55.91 28.35 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.637 0.775 . . . . 10.0 111.351 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.537 HG13 HD11 ' A' ' 85' ' ' ILE . 9.8 tp -64.56 -33.24 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.576 0.626 . . . . 10.0 112.564 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 39.1 t80 -57.65 -52.5 65.17 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 119.126 0.876 . . . . 10.0 110.459 169.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -62.21 -13.3 9.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -97.29 -36.16 10.49 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.494 1.518 . . . . 10.0 112.785 -175.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -137.01 3.63 2.68 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 116.373 1.99 . . . . 10.0 116.373 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.401 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.7 m -122.77 -43.02 2.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.208 1.403 . . . . 10.0 111.839 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.5 4.9 2.06 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.667 1.358 . . . . 10.0 114.667 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -38.46 14.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.511 1.524 . . . . 10.0 111.932 172.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 m -88.61 -38.04 15.15 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.487 2.315 . . . . 10.0 113.751 168.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.425 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.6 m-70 -114.66 -172.59 2.14 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 129.137 2.975 . . . . 10.0 111.917 -175.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.4 m -166.41 153.1 9.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.68 1.992 . . . . 10.0 108.163 157.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.8 p -156.65 -35.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 113.562 0.949 . . . . 10.0 113.562 169.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -60.33 -4.13 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 130.675 3.59 . . . . 10.0 115.96 -168.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -151.17 7.35 0.52 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.68 2.792 . . . . 10.0 111.662 -170.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.36 0 C-N-CA 125.536 1.541 . . . . 10.0 111.943 -161.081 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 118.916 -0.564 . . . . 10.0 111.852 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.425 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -128.18 172.57 19.16 Favored Glycine 0 CA--C 1.544 1.887 0 C-N-CA 124.488 1.042 . . . . 10.0 110.964 150.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.21 166.02 22.51 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 124.392 3.395 . . . . 10.0 112.416 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.98 137.67 57.88 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.07 -1.019 . . . . 10.0 109.196 159.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.83 60.98 2.38 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.349 1.431 . . . . 10.0 111.981 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.18 87.65 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 130.263 3.425 . . . . 10.0 113.568 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.36 43.04 65.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.953 1.74 . . . . 10.0 114.663 169.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -72.4 149.6 44.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 117.849 0.825 . . . . 10.0 110.577 173.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 75.52 76.41 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.017 2.527 . . . . 10.0 111.609 -161.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.54 29.97 0.23 Allowed Glycine 0 CA--C 1.536 1.361 0 N-CA-C 117.353 1.701 . . . . 10.0 117.353 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.477 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 13.0 ptt85 -152.53 -84.17 0.08 Allowed 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 120.748 2.274 . . . . 10.0 115.787 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 16.7 pttp -168.28 -176.38 2.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.697 2.799 . . . . 10.0 109.943 -177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -67.15 -132.72 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.718 2.007 . . . . 10.0 111.873 162.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -18.17 115.96 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 1 C-N-CA 130.708 4.004 . . . . 10.0 117.809 -178.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -152.23 3.52 0.37 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 117.971 2.582 . . . . 10.0 117.971 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 155.0 88.64 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 121.299 1.863 . . . . 10.0 111.874 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.29 74.04 3.16 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.243 2.628 . . . . 10.0 109.637 170.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.48 -73.22 1.63 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.03 1.3 . . . . 10.0 111.624 -170.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 t80 43.6 -143.73 0.12 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.632 1.173 . . . . 10.0 110.102 -164.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.8 m -164.5 108.76 0.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.809 2.044 . . . . 10.0 108.096 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -152.8 176.53 11.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.151 1.38 . . . . 10.0 112.211 -172.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.4 p -80.35 109.78 15.17 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.021 0.915 . . . . 10.0 111.99 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -55.05 -22.41 15.79 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.743 0.817 . . . . 10.0 112.821 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -48.72 -43.04 36.98 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.495 1.118 . . . . 10.0 113.445 170.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.416 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 49.9 t-20 -76.58 -38.81 54.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.751 1.221 . . . . 10.0 112.673 172.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 52' ' ' ASN . 6.8 mmpt? -74.93 -52.11 12.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.819 0.847 . . . . 10.0 110.827 -172.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.97 -21.04 66.39 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.62 1.568 . . . . 10.0 113.466 173.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -28.84 62.85 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.426 1.012 . . . . 10.0 112.815 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.04 4.46 72.48 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 123.878 0.751 . . . . 10.0 114.907 168.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 pp -61.26 178.23 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 10.0 111.313 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.0 m -148.77 108.81 4.08 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 123.256 1.503 . . . . 10.0 111.195 -163.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -54.48 116.37 2.62 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.708 2.003 . . . . 10.0 109.24 169.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 -44.98 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.187 1.395 . . . . 10.0 113.07 -168.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -170.03 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.683 1.993 . . . . 10.0 107.32 162.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -47.34 -54.85 10.04 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.353 2.661 . . . . 10.0 112.399 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -52.72 60.83 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 128.371 2.668 . . . . 10.0 111.962 -176.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.06 -28.34 61.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.919 0.888 . . . . 10.0 112.302 -177.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.87 -55.08 33.47 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.562 0.745 . . . . 10.0 109.957 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.54 -43.79 98.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.458 1.103 . . . . 10.0 110.433 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.8 t80 -66.41 -46.58 76.09 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.038 0.935 . . . . 10.0 112.053 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 -37.25 83.23 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.77 1.623 . . . . 10.0 112.698 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.64 -36.76 84.89 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.036 -0.983 . . . . 10.0 113.063 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -163.45 106.19 0.97 Allowed Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 119.685 1.129 . . . . 10.0 111.873 160.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.43 -48.76 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.481 2.121 . . . . 10.0 110.685 -171.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -37.9 77.2 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.177 1.391 . . . . 10.0 112.475 179.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -61.6 -54.54 41.57 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.69 1.196 . . . . 10.0 110.63 168.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -64.43 -45.25 88.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.918 1.081 . . . . 10.0 113.918 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 pt -136.0 95.45 13.62 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 123.992 0.917 . . . . 10.0 110.548 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.01 76.69 2.05 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 125.035 3.824 . . . . 10.0 113.84 -163.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.51 -25.5 0.03 OUTLIER Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.222 1.868 . . . . 10.0 112.061 165.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.3 t -40.02 116.91 0.7 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.864 2.066 . . . . 10.0 113.975 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -83.18 16.0 2.62 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.148 0.795 . . . . 10.0 113.148 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.8 ttt -67.16 79.1 0.14 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.845 1.307 . . . . 10.0 111.344 171.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tp -72.99 87.07 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 125.307 1.443 . . . . 10.0 111.714 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -161.49 -51.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.01 -0.995 . . . . 10.0 113.547 175.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.02 92.96 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.137 2.175 . . . . 10.0 115.871 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.22 -178.86 36.05 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.638 1.113 . . . . 10.0 111.436 -169.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.537 HD11 HG13 ' A' ' 9' ' ' ILE . 13.5 tt -155.55 82.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.201 1.0 . . . . 10.0 110.35 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 59.78 -54.18 0.07 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 128.065 2.546 . . . . 10.0 116.157 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.24 166.53 25.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.021 2.529 . . . . 10.0 110.417 -174.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -53.95 -46.23 71.51 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.189 0.995 . . . . 10.0 113.083 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.1 m -68.34 -34.32 75.88 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.669 -0.644 . . . . 10.0 111.896 -175.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -76.86 -10.5 59.41 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.372 1.069 . . . . 10.0 113.445 171.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -35.22 35.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.098 -1.626 . . . . 10.0 114.436 155.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -62.33 -57.14 12.45 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.153 -0.967 . . . . 10.0 111.333 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 58.5 p30 -54.92 -40.65 70.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.725 1.21 . . . . 10.0 112.804 -175.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 85' ' ' ILE . 14.9 tp -60.94 -53.88 51.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.912 2.485 . . . . 10.0 112.996 177.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.02 -44.92 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.185 0.994 . . . . 10.0 108.872 174.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.02 -49.97 75.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.661 0.385 . . . . 10.0 111.369 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.8 -61.75 2.1 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.267 1.427 . . . . 10.0 112.068 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.2 mt -59.65 -38.12 80.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.66 1.118 . . . . 10.0 111.815 -176.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -64.76 -24.45 67.56 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.277 1.031 . . . . 10.0 113.596 176.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.512 ' HA ' ' HE2' ' A' ' 100' ' ' LYS . 8.5 mmpt? -87.37 -40.33 14.52 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.847 -1.073 . . . . 10.0 112.239 166.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.68 -22.76 65.6 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.379 1.251 . . . . 10.0 114.379 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t -85.73 9.35 16.67 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 169.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -151.58 21.09 0.72 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.454 2.302 . . . . 10.0 111.88 -166.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.817 1.647 . . . . 10.0 111.217 -174.904 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -81.99 -177.81 6.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.282 0.633 . . . . 10.0 109.493 160.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.03 -34.14 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 120.672 -1.268 . . . . 10.0 111.041 145.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -71.55 -38.75 70.96 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 127.937 2.495 . . . . 10.0 113.557 -157.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.413 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 3.6 mmpt? -63.6 -31.33 72.47 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 173.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.19 -54.04 9.65 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 127.254 2.359 . . . . 10.0 110.29 -173.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -44.91 85.4 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.098 0.777 . . . . 10.0 113.098 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -26.97 60.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.93 1.455 . . . . 10.0 114.93 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -81.39 -32.49 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.669 1.577 . . . . 10.0 111.67 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.41 -51.33 69.87 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 121.677 -0.639 . . . . 10.0 110.219 170.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.99 -12.01 8.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -83.54 -61.3 1.87 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.232 1.013 . . . . 10.0 110.855 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -102.64 -38.25 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.599 1.16 . . . . 10.0 112.457 -170.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.7 m -83.08 -55.17 4.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.128 1.371 . . . . 10.0 111.902 -172.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.61 -15.74 42.03 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -172.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -59.6 -54.52 45.47 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 129.378 3.071 . . . . 10.0 111.898 167.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.8 m -87.5 -21.22 25.61 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.117 1.525 . . . . 10.0 115.117 169.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -134.7 57.64 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.966 1.706 . . . . 10.0 111.991 -167.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.83 120.29 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.72 -1.238 . . . . 10.0 110.827 -174.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.48 -58.39 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 127.068 2.147 . . . . 10.0 108.792 -177.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 -62.31 9.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.187 2.995 . . . . 10.0 114.376 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -151.86 17.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.16 1.784 . . . . 10.0 112.75 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.287 0 C-N-CA 125.847 1.689 . . . . 10.0 111.444 -175.702 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 114.144 1.165 . . . . 10.0 114.144 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.5 166.81 12.44 Favored Glycine 0 CA--C 1.543 1.826 0 CA-C-N 120.191 1.36 . . . . 10.0 113.7 169.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.79 173.58 14.18 Favored 'Trans proline' 0 CA--C 1.541 0.836 1 C-N-CA 125.326 4.017 . . . . 10.0 111.097 167.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.511 HD21 ' CD2' ' A' ' 33' ' ' HIS . 5.9 p30 -77.58 -172.48 2.58 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.222 -0.924 . . . . 10.0 108.745 158.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.1 mt -139.37 51.98 1.75 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 122.798 1.285 . . . . 10.0 111.866 -175.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.511 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -54.22 134.78 44.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.866 2.866 . . . . 10.0 113.165 162.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 54.0 8.38 1.01 Allowed Glycine 0 CA--C 1.54 1.616 0 N-CA-C 118.883 2.313 . . . . 10.0 118.883 160.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -51.55 167.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.784 1.634 . . . . 10.0 111.027 170.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 61.99 36.31 15.64 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.765 1.226 . . . . 10.0 112.554 -169.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 168.4 -42.82 0.23 Allowed Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.565 1.555 . . . . 10.0 110.894 -175.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 41.6 mtp85 -80.81 159.65 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 122.442 1.115 . . . . 10.0 112.067 167.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -70.71 173.91 6.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.682 1.993 . . . . 10.0 110.998 168.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -67.74 168.76 10.77 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.327 1.851 . . . . 10.0 111.334 157.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 53' ' ' LYS . . . 94.08 14.69 51.01 Favored Glycine 0 N--CA 1.471 0.998 0 N-CA-C 117.657 1.823 . . . . 10.0 117.657 160.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.86 -40.52 11.14 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.952 2.101 . . . . 10.0 115.269 -158.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.63 111.17 2.81 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.13 1.372 . . . . 10.0 114.228 -164.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 131.01 18.79 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.417 2.078 . . . . 10.0 112.129 -174.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.01 1.8 69.49 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.91 0.724 . . . . 10.0 114.91 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -73.2 179.27 3.96 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 118.433 1.117 . . . . 10.0 111.052 167.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 98.7 m -154.18 89.02 1.26 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 119.517 -1.99 . . . . 10.0 109.631 176.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.35 173.61 10.8 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 128.508 2.723 . . . . 10.0 112.277 172.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.8 p -71.21 143.87 50.31 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.423 -0.798 . . . . 10.0 110.508 163.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -76.23 65.14 2.13 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.648 -1.283 . . . . 10.0 111.154 166.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.96 -59.35 0.6 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.203 1.001 . . . . 10.0 110.474 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -54.88 -70.1 0.11 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.919 1.687 . . . . 10.0 111.231 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HB3' ' HA2' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -63.68 -13.13 40.07 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 130.566 3.547 . . . . 10.0 115.309 171.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.29 -56.27 7.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.178 -0.951 . . . . 10.0 111.485 160.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -56.3 -27.95 57.2 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.385 1.874 . . . . 10.0 115.448 -170.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.97 7.09 61.54 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.967 1.147 . . . . 10.0 115.967 168.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -56.93 5.96 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 129.463 3.105 . . . . 10.0 117.155 -171.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.6 m 50.59 87.8 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.39 2.676 . . . . 10.0 113.627 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -54.45 125.17 18.48 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.601 2.361 . . . . 10.0 114.987 -171.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -164.66 179.17 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.386 2.674 . . . . 10.0 109.343 -173.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -58.01 -39.3 77.96 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.173 -0.954 . . . . 10.0 112.784 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.89 10.28 0.22 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.444 1.898 . . . . 10.0 115.251 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.2 p -158.21 -33.13 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.757 1.223 . . . . 10.0 111.464 -166.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.13 -29.35 63.98 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 120.469 1.486 . . . . 10.0 112.508 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 73.9 mtm -71.52 -40.1 70.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.251 0.932 . . . . 10.0 111.844 175.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -50.48 72.02 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 167.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.5 -44.73 86.12 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 113.361 0.874 . . . . 10.0 113.361 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.548 ' HB2' HH11 ' A' ' 91' ' ' ARG . 2.7 mm? -73.38 -22.59 60.23 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 121.047 1.749 . . . . 10.0 113.715 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -85.75 -23.85 27.13 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.26 1.208 . . . . 10.0 114.26 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.64 65.56 1.97 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.942 1.297 . . . . 10.0 111.445 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -62.05 -51.55 3.61 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.993 2.462 . . . . 10.0 113.267 -164.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -70.72 -20.8 62.62 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.165 1.786 . . . . 10.0 112.734 -173.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -76.28 -54.39 6.85 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.376 1.47 . . . . 10.0 111.148 163.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -56.87 -45.8 82.24 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.191 0.597 . . . . 10.0 112.335 -175.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.2 pt -133.44 111.91 12.83 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.632 1.173 . . . . 10.0 109.663 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.91 161.11 40.91 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.789 1.66 . . . . 10.0 110.306 175.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.36 5.8 82.58 Favored Glycine 0 CA--C 1.536 1.373 0 CA-C-O 118.648 -1.085 . . . . 10.0 114.769 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m -93.79 122.22 36.04 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.526 1.663 . . . . 10.0 110.769 165.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.26 -10.19 55.05 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.598 1.332 . . . . 10.0 114.598 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttt -21.65 97.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.855 2.862 . . . . 10.0 114.853 -172.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.8 mp -80.09 69.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 125.652 1.581 . . . . 10.0 109.93 -172.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -164.23 -37.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.069 1.747 . . . . 10.0 111.662 170.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.31 -8.7 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 120.8 3.63 . . . . 10.0 120.8 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.09 118.94 0.75 Allowed Glycine 0 CA--C 1.53 1.003 0 CA-C-N 121.185 1.812 . . . . 10.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.0 tt -66.78 -1.71 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 115.332 1.604 . . . . 10.0 115.332 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.0 tttt 70.34 178.01 0.26 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.09 1.756 . . . . 10.0 111.302 -177.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.42 ' HE2' ' OE2' ' A' ' 90' ' ' GLU . 17.8 mtmm 34.26 -105.3 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 127.435 2.294 . . . . 10.0 112.931 -172.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -178.86 -42.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 CA-C-N 120.449 1.477 . . . . 10.0 114.036 171.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.1 m -54.06 -34.63 60.58 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.604 1.162 . . . . 10.0 111.785 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.42 ' OE2' ' HE2' ' A' ' 87' ' ' LYS . 50.2 mp0 -51.75 -41.5 61.64 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.205 2.202 . . . . 10.0 111.891 172.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.548 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -69.17 -49.0 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.357 1.463 . . . . 10.0 110.829 -178.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -68.39 -32.97 73.41 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.533 1.06 . . . . 10.0 112.503 175.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -44.67 96.7 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.37 -0.832 . . . . 10.0 111.439 169.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp -58.53 -35.79 72.85 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.023 1.119 . . . . 10.0 114.023 171.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.51 -53.14 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.88 0.764 . . . . 10.0 109.17 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -49.42 77.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.871 0.468 . . . . 10.0 111.72 178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.22 -50.88 68.28 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.148 1.379 . . . . 10.0 112.662 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.78 -32.56 65.69 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.861 1.664 . . . . 10.0 112.31 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.07 -38.83 80.36 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.132 0.878 . . . . 10.0 111.618 170.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -65.41 -70.91 0.21 Allowed 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 117.282 -1.342 . . . . 10.0 111.635 163.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.41 -17.57 13.54 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 116.146 1.906 . . . . 10.0 116.146 -166.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 28.4 p -76.23 -0.45 22.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.437 1.495 . . . . 10.0 114.131 167.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.52 -19.89 0.17 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.925 2.49 . . . . 10.0 114.944 -178.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.227 2.611 . . . . 10.0 110.901 -171.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.77 0 CA-C-O 119.03 -0.872 . . . . 10.0 111.696 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -129.98 147.33 51.72 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.524 0.935 . . . . 10.0 113.524 -150.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.1 -53.77 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.324 1.45 . . . . 10.0 111.615 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.02 -50.2 74.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.893 1.677 . . . . 10.0 113.496 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.96 -37.08 42.3 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 124.099 0.96 . . . . 10.0 112.082 167.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.28 -52.93 8.1 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.619 -1.392 . . . . 10.0 109.619 -174.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -58.09 -47.12 84.18 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 118.974 1.387 . . . . 10.0 112.31 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -27.0 65.26 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 tp -90.65 -28.82 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.58 1.082 . . . . 10.0 112.551 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.48 -53.02 62.41 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.597 0.759 . . . . 10.0 109.771 166.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.43 -10.63 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -84.99 -57.68 3.0 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.723 1.209 . . . . 10.0 110.895 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -130.41 13.22 5.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.268 1.581 . . . . 10.0 115.268 -168.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.1 m -120.57 -45.29 2.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.906 1.283 . . . . 10.0 111.548 170.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.42 -28.79 70.04 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 114.201 1.186 . . . . 10.0 114.201 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -4.25 3.22 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.709 1.604 . . . . 10.0 114.282 171.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -143.56 6.69 1.46 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.168 2.187 . . . . 10.0 112.69 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -158.47 102.28 1.72 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.746 1.619 . . . . 10.0 108.903 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 p -52.6 -47.83 66.67 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.087 1.884 . . . . 10.0 116.087 -169.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.411 HG22 ' HB2' ' A' ' 32' ' ' LEU . 5.6 t 34.12 -82.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 130.134 3.374 . . . . 10.0 115.857 170.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.27 2.22 0.89 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.081 2.152 . . . . 10.0 113.272 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -151.16 134.31 15.99 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 128.839 2.856 . . . . 10.0 107.87 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.063 0 C-N-CA 123.993 0.806 . . . . 10.0 113.574 -172.642 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 117.203 2.298 . . . . 10.0 117.203 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.68 148.76 20.03 Favored Glycine 0 CA--C 1.538 1.496 0 CA-C-N 120.97 1.713 . . . . 10.0 111.787 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -78.34 61.71 7.92 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.019 3.146 . . . . 10.0 114.801 -160.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 49.11 0.81 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 120.536 3.532 . . . . 10.0 120.536 165.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.411 ' HB2' HG22 ' A' ' 20' ' ' VAL . 1.5 mm? 42.56 60.41 2.4 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.592 1.957 . . . . 10.0 110.798 -171.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.79 168.51 0.28 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.92 -1.036 . . . . 10.0 109.678 157.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -23.27 110.57 0.01 OUTLIER Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.645 1.593 . . . . 10.0 113.519 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.95 -74.59 0.61 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.799 1.24 . . . . 10.0 110.036 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -64.88 84.99 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.506 1.922 . . . . 10.0 111.34 -171.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.71 -4.42 2.45 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.756 1.645 . . . . 10.0 114.696 -172.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -152.74 -172.23 4.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.365 1.466 . . . . 10.0 111.2 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -85.62 -173.71 4.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -175.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -60.78 -151.84 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.004 1.722 . . . . 10.0 111.992 158.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 95.07 -67.33 1.23 Allowed Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.662 -1.899 . . . . 10.0 116.314 167.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -69.25 25.33 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 118.954 2.946 . . . . 10.0 118.954 -152.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.24 113.59 8.41 Favored Pre-proline 0 CA--C 1.554 1.109 0 CA-C-N 121.562 1.983 . . . . 10.0 112.755 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.56 70.78 6.73 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.34 2.693 . . . . 10.0 112.832 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.86 69.76 1.16 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.556 1.074 . . . . 10.0 112.874 172.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -151.74 176.65 11.19 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.064 1.746 . . . . 10.0 109.04 174.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -152.19 115.6 4.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.908 2.083 . . . . 10.0 107.885 -165.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -61.23 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.195 1.398 . . . . 10.0 111.103 -161.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.7 t -162.57 165.73 25.6 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 128.802 2.841 . . . . 10.0 108.874 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.08 -67.5 0.6 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.597 1.159 . . . . 10.0 110.741 157.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.21 -65.07 0.21 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 129.111 2.965 . . . . 10.0 115.333 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -51.87 -70.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.07 0.85 . . . . 10.0 111.57 -176.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -74.46 -16.6 60.85 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.853 -165.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.85 -57.66 7.4 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.852 1.261 . . . . 10.0 113.775 157.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -14.93 48.02 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 115.673 1.731 . . . . 10.0 115.673 -163.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.55 11.06 85.66 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 117.915 1.926 . . . . 10.0 117.915 151.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.72 156.16 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 119.819 1.81 . . . . 10.0 113.458 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 m -68.02 108.87 3.24 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.46 1.504 . . . . 10.0 110.716 176.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.76 112.38 13.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.82 -0.55 . . . . 10.0 111.555 172.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -162.17 -162.57 0.84 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.03 1.332 . . . . 10.0 109.695 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' HD12 ' A' ' 95' ' ' ILE . 40.3 tt0 -41.84 -66.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 131.091 3.756 . . . . 10.0 113.21 -174.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -58.36 -54.62 44.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.247 1.419 . . . . 10.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 78.7 p -67.84 -35.9 79.39 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.039 0.936 . . . . 10.0 112.973 -173.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.18 -27.51 59.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 119.832 1.196 . . . . 10.0 113.504 173.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 69.6 mtm -65.91 -52.13 52.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 119.446 1.021 . . . . 10.0 109.406 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.9 -44.38 91.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.136 0.493 . . . . 10.0 110.477 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -63.89 -55.72 20.63 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -75.22 -10.78 59.78 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 121.066 1.757 . . . . 10.0 113.348 -177.729 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -85.37 -25.42 27.08 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.798 1.181 . . . . 10.0 113.978 167.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -162.33 98.37 1.14 Allowed Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.618 1.099 . . . . 10.0 112.974 157.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.35 -47.68 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.765 1.643 . . . . 10.0 112.042 -167.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -64.89 -32.01 73.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.456 1.502 . . . . 10.0 113.027 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -75.78 -39.13 57.53 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-O 118.108 -0.949 . . . . 10.0 112.728 168.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -68.8 -40.18 79.72 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.517 0.932 . . . . 10.0 113.517 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.02 135.25 25.53 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.803 0.841 . . . . 10.0 110.998 174.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -80.18 50.54 3.57 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.088 3.192 . . . . 10.0 114.544 -157.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.48 61.77 0.01 OUTLIER Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.422 -0.799 . . . . 10.0 114.637 172.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -80.1 -30.16 39.13 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.463 1.283 . . . . 10.0 114.463 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 -22.28 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 117.001 2.223 . . . . 10.0 117.001 -166.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.9 ttt -34.76 100.52 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 129.071 2.948 . . . . 10.0 113.803 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 28.5 mt -76.41 71.74 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 125.879 1.672 . . . . 10.0 109.644 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -163.51 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.254 1.022 . . . . 10.0 113.236 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.78 -15.13 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 120.26 3.43 . . . . 10.0 120.26 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.67 158.52 28.69 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-N 121.695 2.043 . . . . 10.0 113.498 172.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.468 HG23 ' H ' ' A' ' 86' ' ' LYS . 16.3 tt -78.96 -79.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.111 1.523 . . . . 10.0 115.111 -169.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.468 ' H ' HG23 ' A' ' 85' ' ' ILE . 20.6 mtpt -156.9 -52.76 0.08 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.024 1.73 . . . . 10.0 111.635 -169.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -162.99 161.41 25.53 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 129.627 3.171 . . . . 10.0 107.306 174.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -57.26 -46.66 82.84 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.998 0.74 . . . . 10.0 112.998 -168.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . 0.266 83.5 m -64.56 -26.61 68.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.368 1.248 . . . . 10.0 114.368 -176.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.77 -33.84 76.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.357 1.435 . . . . 10.0 111.621 169.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.472 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.29 -45.11 77.54 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.73 1.612 . . . . 10.0 110.121 170.039 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -63.58 -35.56 80.91 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.99 1.316 . . . . 10.0 112.363 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -63.73 -48.97 74.9 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.822 1.649 . . . . 10.0 111.243 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.42 -35.41 62.88 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 61' ' ' GLU . 20.8 mm -59.37 -57.19 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.34 95.91 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.81 0.444 . . . . 10.0 111.946 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -53.53 -63.23 1.21 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.7 1.2 . . . . 10.0 111.522 170.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.24 -27.93 69.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.605 1.093 . . . . 10.0 113.426 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -59.54 -16.76 27.03 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.693 1.133 . . . . 10.0 113.511 170.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.41 33.57 3.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.801 2.04 . . . . 10.0 113.235 165.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.23 24.58 2.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.586 1.155 . . . . 10.0 111.398 171.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -127.68 2.25 6.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.573 1.549 . . . . 10.0 113.242 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -159.64 -59.0 0.06 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.344 1.857 . . . . 10.0 109.649 -154.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 C--O 1.256 1.426 0 CA-C-O 117.004 -1.474 . . . . 10.0 109.446 134.09 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.029 0 CA-C-O 117.478 -1.734 . . . . 10.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -131.01 168.15 17.85 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 -166.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.58 -65.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.23 2.612 . . . . 10.0 110.596 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.0 -37.59 74.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.404 1.482 . . . . 10.0 113.243 174.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 5.7 mmpt? -64.84 -16.4 63.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.659 -0.686 . . . . 10.0 112.315 171.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.06 -50.58 1.23 Allowed Glycine 0 N--CA 1.468 0.81 0 C-N-CA 125.974 1.749 . . . . 10.0 112.793 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -60.03 -29.62 68.62 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.629 1.215 . . . . 10.0 113.651 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 5' ' ' LYS . 15.8 pttp -64.22 -32.18 73.66 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.995 0.918 . . . . 10.0 112.532 174.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.82 -47.93 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.603 0.761 . . . . 10.0 109.244 168.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -57.54 -53.56 56.82 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.958 0.345 . . . . 10.0 111.46 -174.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.51 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 73.4 t -63.27 -15.42 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 112.706 0.632 . . . . 10.0 112.706 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -95.88 -63.74 1.12 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.051 2.141 . . . . 10.0 111.055 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -87.67 -17.9 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 -171.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -116.22 -52.63 2.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.148 0.979 . . . . 10.0 111.117 -169.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -74.57 3.71 7.27 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.564 0.95 . . . . 10.0 113.564 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.19 -67.22 0.27 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.439 1.896 . . . . 10.0 108.777 153.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.9 m -82.2 -35.36 28.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.137 1.375 . . . . 10.0 113.906 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.78 -163.0 0.96 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.861 2.465 . . . . 10.0 112.38 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' N ' ' A' ' 20' ' ' VAL . 8.3 t -138.15 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.477 1.111 . . . . 10.0 113.215 169.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' N ' HG23 ' A' ' 19' ' ' THR . 0.4 OUTLIER 40.97 -25.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.346 1 C-N-CA 132.86 4.464 . . . . 10.0 118.295 -161.994 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -140.55 -61.33 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.275 2.23 . . . . 10.0 109.742 -169.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -78.32 88.52 4.35 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.035 0.754 . . . . 10.0 113.035 177.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.42 0 N-CA-C 118.627 2.211 . . . . 10.0 118.627 150.409 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 119.425 -0.321 . . . . 10.0 111.716 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.56 163.22 28.99 Favored Glycine 0 CA--C 1.544 1.859 0 C-N-CA 124.984 1.278 . . . . 10.0 111.662 164.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.36 175.22 2.81 Favored 'Trans proline' 0 C--N 1.353 0.794 1 C-N-CA 125.653 4.236 . . . . 10.0 113.901 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -86.9 0.39 55.09 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.598 1.333 . . . . 10.0 114.598 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 mp 58.27 -31.63 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.105 3.362 . . . . 10.0 115.714 -174.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.09 68.13 0.16 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.549 3.14 . . . . 10.0 113.251 176.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.45 -51.74 2.21 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 126.75 2.119 . . . . 10.0 113.867 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 tp 66.86 -58.12 0.4 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.222 2.609 . . . . 10.0 115.252 173.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.16 115.77 6.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.392 1.077 . . . . 10.0 109.588 -170.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 -8.04 71.59 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 127.076 2.274 . . . . 10.0 114.217 -174.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -87.79 -83.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.082 1.353 . . . . 10.0 114.469 -168.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.65 175.42 1.09 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.341 2.656 . . . . 10.0 111.991 161.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.1 t -82.24 166.31 19.68 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.997 2.119 . . . . 10.0 111.371 163.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.12 -14.64 2.16 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 126.116 1.817 . . . . 10.0 116.789 159.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.72 -5.48 5.88 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 129.042 2.937 . . . . 10.0 115.333 -173.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -46.78 128.54 8.56 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 126.009 1.724 . . . . 10.0 111.851 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.62 106.4 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 123.233 2.622 . . . . 10.0 111.153 -172.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.53 -44.38 1.43 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.21 1.386 . . . . 10.0 113.724 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.43 134.48 56.49 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 122.467 1.127 . . . . 10.0 110.287 -173.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.4 m -150.73 86.36 1.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 123.607 1.67 . . . . 10.0 106.823 -156.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.48 142.8 30.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 131.621 3.968 . . . . 10.0 108.305 173.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.6 t 45.36 -138.31 0.49 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.74 0.816 . . . . 10.0 111.734 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -161.24 -65.69 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.032 1.733 . . . . 10.0 110.433 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.6 -54.69 43.01 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.085 1.354 . . . . 10.0 112.607 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -56.84 -45.86 82.09 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 119.676 1.126 . . . . 10.0 112.561 175.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mmmt -53.81 -49.94 67.24 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.386 1.074 . . . . 10.0 111.722 173.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -66.03 -38.41 88.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.842 1.257 . . . . 10.0 113.219 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -161.07 81.88 0.63 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.438 1.895 . . . . 10.0 110.726 -166.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -118.24 165.58 12.79 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.369 1.462 . . . . 10.0 111.289 164.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -68.11 169.34 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.929 1.691 . . . . 10.0 114.807 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.7 m -72.22 110.19 6.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.296 1.439 . . . . 10.0 111.06 167.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -61.66 140.83 58.12 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.425 1.09 . . . . 10.0 111.388 161.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -178.31 -33.03 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 125.731 1.612 . . . . 10.0 114.998 -169.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 166.46 -61.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.696 2.798 . . . . 10.0 112.306 158.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -41.49 85.31 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.84 1.256 . . . . 10.0 112.091 -177.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -54.71 -38.86 67.58 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.596 1.159 . . . . 10.0 112.579 168.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.2 mp -75.35 -28.64 59.66 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 119.881 1.219 . . . . 10.0 113.579 172.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 38.3 mtt -61.53 -53.61 54.11 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.987 1.267 . . . . 10.0 108.589 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.14 -37.81 88.6 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.699 0.285 . . . . 10.0 110.977 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.04 -45.54 81.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.198 -0.906 . . . . 10.0 113.183 175.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -37.88 89.05 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 120.931 1.696 . . . . 10.0 111.633 176.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -70.2 -24.65 63.15 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.726 1.38 . . . . 10.0 114.726 174.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.8 75.71 2.3 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 119.855 1.207 . . . . 10.0 114.01 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -70.88 -45.71 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.973 1.782 . . . . 10.0 112.224 -168.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -68.84 21.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.82 2.848 . . . . 10.0 114.658 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -161.47 -30.75 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.843 1.657 . . . . 10.0 112.786 -167.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.774 1.028 . . . . 10.0 113.774 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.11 157.11 79.11 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 125.419 1.488 . . . . 10.0 110.257 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.11 117.92 5.26 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.604 2.203 . . . . 10.0 110.603 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 85.64 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.802 1.191 . . . . 10.0 113.612 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -127.28 150.61 49.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.053 1.341 . . . . 10.0 110.53 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -142.0 26.6 1.85 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.763 1.625 . . . . 10.0 113.118 -171.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.3 ttt -55.8 103.97 0.12 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.84 0.856 . . . . 10.0 110.554 159.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.73 79.98 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.578 1.151 . . . . 10.0 109.467 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -161.91 -63.29 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.153 0.581 . . . . 10.0 111.983 174.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.48 -2.63 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 120.495 3.517 . . . . 10.0 120.495 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -145.6 86.47 0.17 Allowed Glycine 0 CA--C 1.529 0.937 0 CA-C-N 120.9 1.682 . . . . 10.0 112.262 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.8 tt -64.24 -57.76 10.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 114.12 1.155 . . . . 10.0 114.12 -170.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm 163.4 -168.75 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 131.667 3.987 . . . . 10.0 109.095 -174.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -53.12 -61.78 2.07 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 128.335 2.654 . . . . 10.0 115.582 -167.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.5 -40.61 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.518 1.527 . . . . 10.0 114.456 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -50.82 60.31 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.397 1.479 . . . . 10.0 111.656 -173.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -53.9 -49.06 69.43 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.389 0.675 . . . . 10.0 110.994 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -33.34 75.24 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.517 1.127 . . . . 10.0 112.788 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -76.68 -33.88 58.23 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 120.394 1.452 . . . . 10.0 114.428 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -69.91 -46.5 65.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.606 1.094 . . . . 10.0 112.069 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.58 -39.99 85.91 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.75 1.22 . . . . 10.0 113.265 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mm -65.0 -44.01 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.289 1.036 . . . . 10.0 110.479 173.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.73 -41.2 97.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.299 0.64 . . . . 10.0 111.75 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -56.72 -59.01 5.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.203 1.001 . . . . 10.0 112.418 170.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.8 -27.68 66.08 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.931 1.086 . . . . 10.0 113.931 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -58.89 -28.19 65.92 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.654 1.182 . . . . 10.0 112.637 167.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -81.94 -51.92 7.59 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.931 1.293 . . . . 10.0 111.549 167.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.45 -12.52 15.07 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 116.39 1.996 . . . . 10.0 116.39 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.3 t -72.3 -0.8 13.18 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.723 -1.235 . . . . 10.0 114.312 164.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -151.12 -22.32 0.21 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.94 1.696 . . . . 10.0 113.519 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 127.652 2.381 . . . . 10.0 109.965 172.148 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.822 0 CA-C-O 119.263 -0.743 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -127.78 136.55 51.64 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.623 0.725 . . . . 10.0 112.583 -150.096 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.49 -58.86 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.141 1.777 . . . . 10.0 110.989 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -60.25 -48.58 81.11 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.031 1.333 . . . . 10.0 113.153 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -53.33 -35.01 59.73 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.497 0.719 . . . . 10.0 111.721 170.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.31 -53.55 7.56 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.934 1.254 . . . . 10.0 110.38 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 97' ' ' TYR . 1.2 ptpt -58.75 -44.73 90.62 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.346 1.573 . . . . 10.0 112.679 177.154 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -39.7 79.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 118.07 -0.967 . . . . 10.0 112.898 -178.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -73.47 -33.16 39.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.929 1.241 . . . . 10.0 111.955 174.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -56.78 -50.56 71.95 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.284 -0.885 . . . . 10.0 110.077 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.487 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 55.2 t -60.15 -14.29 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 177.255 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -94.22 -56.62 2.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.267 1.427 . . . . 10.0 111.503 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -108.11 1.66 22.45 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.15 1.537 . . . . 10.0 115.15 -172.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.0 m -123.8 -49.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.126 1.37 . . . . 10.0 112.455 -179.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.487 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -69.68 2.93 2.81 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.921 1.082 . . . . 10.0 113.921 178.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -59.03 6.1 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.477 -0.764 . . . . 10.0 109.359 158.215 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.4 m -87.58 -28.06 22.16 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.608 1.336 . . . . 10.0 114.608 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -108.35 -168.95 1.43 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.795 2.038 . . . . 10.0 111.558 -176.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.285 6.5 t -137.33 -75.17 0.41 Allowed 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 117.471 -1.252 . . . . 10.0 113.33 165.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 6.7 p 45.58 -56.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 130.394 3.478 . . . . 10.0 116.587 -170.553 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -67.93 -10.14 50.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.245 1.818 . . . . 10.0 113.309 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -152.71 148.68 27.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.391 1.877 . . . . 10.0 110.356 -171.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 C-N-CA 125.486 1.517 . . . . 10.0 112.905 -176.359 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 119.698 -0.191 . . . . 10.0 111.045 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.67 176.91 16.57 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 126.047 1.784 . . . . 10.0 111.471 166.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.89 177.13 8.07 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.952 3.101 . . . . 10.0 112.266 177.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.53 10.48 27.71 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.941 2.096 . . . . 10.0 114.743 -175.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 mp 57.6 -16.59 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 128.809 2.844 . . . . 10.0 116.029 -176.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.94 68.99 0.15 Allowed 'General case' 0 C--O 1.24 0.591 0 C-N-CA 129.546 3.138 . . . . 10.0 115.768 156.738 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 67.02 2.37 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 125.503 1.525 . . . . 10.0 111.11 -176.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.01 171.29 2.28 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 117.993 0.896 . . . . 10.0 112.304 -176.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 76.37 130.09 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 127.642 2.377 . . . . 10.0 114.424 171.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.44 -39.82 1.5 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.004 1.764 . . . . 10.0 113.822 -179.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -169.93 0.68 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.777 1.631 . . . . 10.0 113.929 174.089 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.2 mtmm -77.43 -164.43 0.48 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.793 1.637 . . . . 10.0 113.036 -174.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -107.3 -99.03 0.36 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 117.586 -1.197 . . . . 10.0 109.981 168.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 7.54 -103.94 0.01 OUTLIER Glycine 0 N--CA 1.477 1.389 0 C-N-CA 130.144 3.735 . . . . 10.0 117.743 -177.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 46.42 -14.27 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.087 1 C-N-CA 133.179 4.592 . . . . 10.0 121.695 161.208 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 109.98 2.85 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 121.377 1.899 . . . . 10.0 114.04 -174.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.26 62.59 8.49 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 124.037 3.158 . . . . 10.0 113.593 -167.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.45 50.97 0.08 OUTLIER Glycine 0 N--CA 1.473 1.11 0 C-N-CA 124.924 1.25 . . . . 10.0 113.299 175.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -145.92 -177.86 5.81 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.197 2.199 . . . . 10.0 108.078 -176.026 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.7 m -154.49 135.53 13.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 119.715 -1.866 . . . . 10.0 109.105 176.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -138.64 173.83 11.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.09 1.356 . . . . 10.0 112.061 -166.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.8 p -69.63 160.49 31.47 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.185 1.394 . . . . 10.0 112.557 172.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -64.8 -178.19 0.4 Allowed 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 114.916 -1.038 . . . . 10.0 111.041 161.44 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.02 -72.0 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.914 2.485 . . . . 10.0 114.02 -173.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -62.36 -64.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.153 0.978 . . . . 10.0 112.273 -169.09 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -39.64 43.95 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.531 -1.355 . . . . 10.0 113.869 175.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -65.63 -60.74 2.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.881 0.764 . . . . 10.0 112.741 178.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 56' ' ' GLY . 0.2 OUTLIER -77.37 -48.56 16.98 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.646 0.778 . . . . 10.0 112.766 -176.843 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 55' ' ' LYS . . . 71.11 176.3 23.03 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.123 1.344 . . . . 10.0 115.481 -177.82 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -168.46 2.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 127.568 2.347 . . . . 10.0 112.099 -165.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . 0.266 2.4 m 53.83 113.64 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.022 2.529 . . . . 10.0 114.979 -174.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -64.5 156.22 30.35 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.524 -1.216 . . . . 10.0 110.26 163.146 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -174.43 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.697 1.599 . . . . 10.0 112.104 -175.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 165.69 -64.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 130.484 3.514 . . . . 10.0 110.012 173.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -46.11 -56.54 5.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.357 1.863 . . . . 10.0 112.769 -179.764 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 75.7 p -61.41 -36.01 79.12 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.679 1.592 . . . . 10.0 112.163 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.466 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.32 -32.37 60.91 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.137 0.975 . . . . 10.0 113.051 173.918 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.9 mtm -63.62 -47.64 80.57 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 118.091 -0.957 . . . . 10.0 109.504 173.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -66.0 -43.01 88.99 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.554 0.616 . . . . 10.0 111.14 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -63.06 -49.8 73.11 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -177.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -43.11 92.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.779 1.172 . . . . 10.0 110.58 -178.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -74.11 -20.93 60.09 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.712 1.375 . . . . 10.0 114.712 -177.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.32 72.12 2.58 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 118.912 0.778 . . . . 10.0 111.355 178.212 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' HG21 ' A' ' 78' ' ' THR . 12.4 Cg_endo -62.91 -61.49 0.14 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.846 3.031 . . . . 10.0 115.44 -165.317 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -68.93 -26.06 64.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.035 0.934 . . . . 10.0 111.694 -178.127 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.38 90.95 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.861 1.264 . . . . 10.0 110.909 166.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -76.21 -53.9 7.58 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.266 -0.896 . . . . 10.0 113.299 178.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.56 119.51 15.18 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.952 1.301 . . . . 10.0 109.37 171.167 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.35 -30.71 44.53 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.864 2.376 . . . . 10.0 113.515 -168.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -74.92 70.62 1.75 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.177 0.894 . . . . 10.0 111.625 172.334 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.477 HG21 ' HB2' ' A' ' 71' ' ' PRO . 2.6 m -138.84 152.41 47.82 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.997 0.919 . . . . 10.0 111.43 172.607 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -141.41 12.87 2.16 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.237 1.815 . . . . 10.0 113.327 -178.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.2 ttt -55.03 93.02 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.255 1.822 . . . . 10.0 111.967 165.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.9 mm -71.79 76.65 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 124.812 1.245 . . . . 10.0 110.086 176.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -162.18 -74.09 0.05 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.959 0.726 . . . . 10.0 112.959 176.33 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.73 -67.94 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.443 2.697 . . . . 10.0 116.46 -169.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.9 82.1 0.12 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 125.984 1.754 . . . . 10.0 112.653 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 tt -61.43 -43.83 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 123.905 0.882 . . . . 10.0 112.293 -165.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.253 10.8 mtpt 161.45 -78.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 130.938 3.695 . . . . 10.0 110.061 146.026 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -77.0 -83.59 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt 173.69 -43.76 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 128.12 2.568 . . . . 10.0 110.706 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.7 m -50.53 -40.59 52.1 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.334 1.853 . . . . 10.0 112.168 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -59.89 -39.78 86.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.446 0.698 . . . . 10.0 111.072 177.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.466 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -62.67 -51.2 68.19 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.104 1.362 . . . . 10.0 109.881 -179.354 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.07 -26.68 59.54 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -66.66 -43.06 85.56 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.605 1.093 . . . . 10.0 110.916 168.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.35 -35.71 72.36 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.439 1.274 . . . . 10.0 114.439 174.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.36 -55.88 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 172.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -43.9 88.74 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.251 0.621 . . . . 10.0 111.946 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 101' ' ' ALA . 3.0 t80 -52.84 -63.41 1.15 Allowed 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.776 1.23 . . . . 10.0 111.739 170.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 89.6 mt -64.23 -30.1 71.17 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.719 1.145 . . . . 10.0 112.334 -174.335 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -57.69 -32.93 67.85 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.241 1.017 . . . . 10.0 112.497 171.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.5 mmtt -80.62 -53.37 6.6 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 125.065 1.346 . . . . 10.0 111.98 165.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.482 ' HB2' ' CE1' ' A' ' 97' ' ' TYR . . . -55.79 -24.3 34.96 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.319 1.97 . . . . 10.0 116.319 -167.143 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.5 t -74.14 2.11 9.7 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.126 0.971 . . . . 10.0 113.599 171.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -152.99 -18.55 0.15 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 127.941 2.496 . . . . 10.0 114.981 -179.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.064 2.146 . . . . 10.0 113.316 -171.996 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 109.266 -1.533 . . . . 10.0 109.266 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.569 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 1.8 m-20 -114.87 -113.56 0.34 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.463 1.505 . . . . 10.0 111.357 -165.397 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -161.51 -59.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 128.39 2.676 . . . . 10.0 107.499 -179.137 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.06 -48.83 75.31 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.398 1.079 . . . . 10.0 112.405 176.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -62.18 -14.89 42.28 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.965 1.098 . . . . 10.0 113.965 172.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.45 -55.8 2.52 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 125.292 1.425 . . . . 10.0 110.032 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 pttt -61.19 -37.48 83.11 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.144 0.972 . . . . 10.0 113.197 -176.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -13.95 60.91 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.216 1.191 . . . . 10.0 114.216 176.578 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.1 mm -103.22 -34.61 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.593 1.157 . . . . 10.0 111.222 169.711 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.6 t80 -54.67 -53.15 58.61 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.611 0.641 . . . . 10.0 110.793 172.065 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -66.61 -8.04 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.513 -0.742 . . . . 10.0 112.637 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.84 -50.04 5.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.501 1.92 . . . . 10.0 111.224 -177.078 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -122.82 -1.23 8.94 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -174.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 22.0 m -117.48 -46.2 2.69 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.562 1.145 . . . . 10.0 111.358 -177.355 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.08 -10.75 6.68 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.063 0.764 . . . . 10.0 113.063 168.296 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -19.02 40.31 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.716 1.606 . . . . 10.0 113.042 166.148 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -143.4 -26.59 0.57 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.537 1.935 . . . . 10.0 115.074 -177.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -110.18 -172.84 2.12 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 128.056 2.542 . . . . 10.0 110.727 179.102 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.7 p -131.16 -82.68 0.52 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.863 1.06 . . . . 10.0 113.863 169.592 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.294 9.9 p 50.96 -45.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 131.507 3.923 . . . . 10.0 116.502 -169.752 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -72.81 -4.33 30.97 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.096 1.358 . . . . 10.0 112.165 170.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -151.66 173.41 14.71 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.588 1.955 . . . . 10.0 110.031 -166.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.152 0 C-N-CA 125.206 1.384 . . . . 10.0 116.512 -163.968 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -123.12 160.43 17.63 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.828 1.204 . . . . 10.0 111.116 166.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -66.56 6.45 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.742 1 C-N-CA 126.905 5.07 . . . . 10.0 117.378 -162.416 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 61.77 159.74 0.06 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.968 2.107 . . . . 10.0 112.171 -147.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.76 78.35 9.58 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.334 -1.358 . . . . 10.0 107.334 165.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 83.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.467 1.107 . . . . 10.0 110.928 176.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.87 -67.66 0.07 OUTLIER Glycine 0 CA--C 1.529 0.936 0 C-N-CA 128.047 2.737 . . . . 10.0 113.158 -178.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.57 -179.84 0.16 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.503 2.721 . . . . 10.0 111.43 -169.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 67.79 82.58 0.17 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.448 1.899 . . . . 10.0 113.504 -174.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.68 -33.69 4.02 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.234 1.873 . . . . 10.0 112.602 169.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -77.62 -168.16 1.12 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.046 1.338 . . . . 10.0 111.576 165.537 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.63 158.5 44.23 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.826 1.25 . . . . 10.0 110.044 -167.87 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -62.25 158.99 15.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 115.357 1.614 . . . . 10.0 115.357 -169.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.65 7.9 38.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.436 1.735 . . . . 10.0 117.436 169.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -100.65 12.35 37.6 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -161.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.42 146.08 89.91 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.031 0.932 . . . . 10.0 113.513 -178.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.63 58.92 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.727 2.951 . . . . 10.0 113.709 178.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 106.96 0.78 36.12 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 125.459 1.504 . . . . 10.0 116.134 168.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.63 132.97 51.23 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.969 1.385 . . . . 10.0 113.266 179.071 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -71.78 84.93 0.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.977 1.711 . . . . 10.0 112.219 175.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.404 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -82.77 175.19 10.31 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.105 1.362 . . . . 10.0 111.478 163.872 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -69.94 158.61 35.28 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.249 -0.907 . . . . 10.0 110.482 171.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 17.4 t0 -75.62 -9.32 58.49 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -178.479 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.16 -77.95 0.21 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.001 0.92 . . . . 10.0 113.162 -170.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -68.11 -23.81 64.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.828 1.418 . . . . 10.0 114.828 -163.084 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HG2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -64.62 -34.94 79.45 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.672 1.124 . . . . 10.0 113.3 169.501 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.82 -69.11 0.35 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.852 0.751 . . . . 10.0 110.693 162.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -76.92 60.81 1.84 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 10.0 112.414 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -85.09 -162.47 35.65 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.539 1.542 . . . . 10.0 114.637 -177.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.0 pt -169.06 146.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 127.79 2.436 . . . . 10.0 107.945 -166.468 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.0 m -72.59 124.4 25.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.058 1.343 . . . . 10.0 110.302 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -75.41 130.99 39.87 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 123.178 0.591 . . . . 10.0 111.277 175.651 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -164.47 161.49 21.4 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.447 2.299 . . . . 10.0 108.942 -168.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.99 46.82 0.06 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.58 1.952 . . . . 10.0 113.374 176.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -162.35 -62.14 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 129.25 3.02 . . . . 10.0 107.543 -171.171 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 44.5 p -65.99 -29.62 70.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 117.681 -1.152 . . . . 10.0 113.05 -177.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.27 -26.65 60.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.679 1.127 . . . . 10.0 112.908 169.577 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.2 mtt -65.54 -53.47 41.69 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.824 1.193 . . . . 10.0 108.421 172.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -67.33 -38.94 85.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.68 -0.236 . . . . 10.0 111.006 -176.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -60.72 -63.31 1.34 Allowed 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 119.044 -0.503 . . . . 10.0 111.453 173.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -32.83 74.56 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 120.155 1.343 . . . . 10.0 111.615 -169.941 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.48 -17.64 55.98 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.922 1.453 . . . . 10.0 114.922 175.501 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.09 56.26 0.81 Allowed Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.329 1.452 . . . . 10.0 112.189 -169.574 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.8 -50.92 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.661 2.241 . . . . 10.0 112.772 -159.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -64.27 -24.77 67.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.462 1.905 . . . . 10.0 112.865 -177.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -75.34 -54.13 7.58 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.948 1.299 . . . . 10.0 110.546 167.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -69.54 -30.71 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 -170.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 pt -140.43 118.13 8.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.465 1.106 . . . . 10.0 109.963 163.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.8 151.69 74.17 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.501 2.134 . . . . 10.0 111.484 -176.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.37 5.49 67.33 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 118.726 -1.041 . . . . 10.0 115.223 179.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 t -75.25 -3.56 33.93 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 116.258 1.947 . . . . 10.0 116.258 -170.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.2 tptp 59.28 -18.88 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 119.316 3.08 . . . . 10.0 119.316 159.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 19.3 ttt -46.32 114.6 0.83 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.904 2.481 . . . . 10.0 112.058 178.0 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.6 mp -82.43 52.72 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.715 1.206 . . . . 10.0 110.427 -176.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -164.06 150.98 11.7 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.02 1.728 . . . . 10.0 108.939 169.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.28 139.36 5.82 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.424 1.49 . . . . 10.0 108.69 177.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.19 87.88 0.49 Allowed Glycine 0 CA--C 1.529 0.911 0 CA-C-N 118.084 0.402 . . . . 10.0 112.837 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.3 tt -68.51 12.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.977 1.843 . . . . 10.0 115.977 -166.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 59.4 -0.26 0.18 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.881 2.549 . . . . 10.0 117.881 173.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -160.27 104.12 1.46 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.879 2.072 . . . . 10.0 109.199 -168.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -67.67 -13.77 62.37 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.338 1.607 . . . . 10.0 115.338 -177.319 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -62.76 -63.22 1.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.005 0.821 . . . . 10.0 109.323 163.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -50.87 -34.71 29.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.447 1.899 . . . . 10.0 112.814 176.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.2 tpm_? -51.18 -50.08 59.69 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 174.049 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -75.52 -43.47 48.79 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.952 1.701 . . . . 10.0 110.641 175.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.569 ' CG ' ' H ' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -57.3 -50.13 73.89 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.078 1.751 . . . . 10.0 112.124 -174.226 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -65.79 -38.68 89.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.4 0.546 . . . . 10.0 112.232 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.8 mt -61.38 -48.82 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.414 0.686 . . . . 10.0 109.492 176.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.67 93.85 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.748 1.219 . . . . 10.0 112.868 176.22 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.422 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -50.16 -53.29 28.72 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.023 1.329 . . . . 10.0 111.394 169.651 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 35.8 mt -67.54 -31.58 71.78 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.381 -0.824 . . . . 10.0 112.843 178.534 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -59.61 -26.88 65.82 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.323 1.231 . . . . 10.0 114.323 167.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.79 -54.36 9.07 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.011 0.823 . . . . 10.0 109.998 162.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.19 -25.48 33.02 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.512 1.671 . . . . 10.0 115.512 -175.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.25 5.6 11.89 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.052 1.341 . . . . 10.0 114.161 172.584 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -150.21 -15.63 0.25 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.564 1.946 . . . . 10.0 113.72 -170.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 C--O 1.258 1.515 0 C-N-CA 126.873 2.069 . . . . 10.0 110.221 -161.488 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.286 0 CA-C-O 119.59 -0.561 . . . . 10.0 111.973 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -131.79 122.3 25.57 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.299 1.04 . . . . 10.0 111.134 -157.068 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -52.82 -55.95 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.012 1.725 . . . . 10.0 111.71 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.8 -44.16 90.71 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 113.646 0.98 . . . . 10.0 113.646 -178.196 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.1 -36.12 72.42 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.156 0.582 . . . . 10.0 110.195 172.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.75 -45.54 16.87 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 124.68 1.133 . . . . 10.0 110.972 -175.029 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -74.95 -29.12 60.85 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -60.86 -53.48 56.78 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.43 1.013 . . . . 10.0 111.051 168.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.9 tp -64.23 -32.28 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 118.787 0.721 . . . . 10.0 112.001 177.34 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.494 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.7 t80 -59.37 -56.93 15.77 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 118.912 0.778 . . . . 10.0 111.311 170.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.32 -9.06 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 O-C-N 121.633 -0.667 . . . . 10.0 112.713 -178.353 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -63.67 1.25 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.743 1.217 . . . . 10.0 110.501 173.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -113.61 -2.78 13.72 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.774 1.768 . . . . 10.0 115.774 -167.795 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.3 m -103.44 -42.96 5.54 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 124.234 1.014 . . . . 10.0 111.23 171.051 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.01 -9.57 4.54 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.233 1.198 . . . . 10.0 114.233 173.191 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.73 -16.43 63.76 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.226 1.41 . . . . 10.0 112.979 167.855 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -143.54 -33.9 0.42 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.828 1.651 . . . . 10.0 113.928 -177.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.403 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 93.2 m-70 -100.76 -178.16 3.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.372 2.269 . . . . 10.0 110.621 173.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.4 t -175.74 117.25 0.15 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.38 1.072 . . . . 10.0 110.771 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.4 p -143.74 -63.64 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.217 1.407 . . . . 10.0 112.761 -173.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -66.45 -32.21 73.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 120.87 1.668 . . . . 10.0 110.507 170.153 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -68.05 120.74 14.78 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.745 1.218 . . . . 10.0 109.065 156.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.331 0 C-N-CA 123.91 0.767 . . . . 10.0 112.914 174.999 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.403 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -119.71 -178.94 16.51 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 126.3 1.905 . . . . 10.0 108.934 155.462 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 92.9 Cg_endo -72.84 -176.45 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 CA-C-N 120.03 1.915 . . . . 10.0 111.251 176.377 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -64.42 -35.92 82.48 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 179.342 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp 67.53 68.48 0.37 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.832 2.853 . . . . 10.0 111.006 -150.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.88 73.71 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.47 1.908 . . . . 10.0 112.619 161.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.58 -67.48 0.41 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 127.402 2.429 . . . . 10.0 114.706 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 54.1 -163.79 0.11 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.116 2.166 . . . . 10.0 113.084 -169.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 67.86 10.14 7.59 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.105 2.562 . . . . 10.0 114.743 -176.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -160.17 13.06 0.18 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.787 1.66 . . . . 10.0 114.16 -179.475 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.51 169.29 24.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.826 1.25 . . . . 10.0 111.943 -177.194 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -65.04 163.28 15.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.85 1.66 . . . . 10.0 112.564 179.245 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.4 p -69.82 164.58 23.34 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.414 0.686 . . . . 10.0 110.957 170.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.46 -112.76 3.78 Favored Glycine 0 N--CA 1.47 0.938 0 CA-C-O 118.193 -1.337 . . . . 10.0 115.68 169.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 38.37 2.41 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 1 C-N-CA 132.02 4.128 . . . . 10.0 121.104 178.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 30' ' ' PRO . . . -44.89 104.25 0.38 Allowed Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 127.653 2.381 . . . . 10.0 114.814 -178.612 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.91 50.73 3.57 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 123.778 2.985 . . . . 10.0 113.217 -172.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.69 49.75 0.1 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.573 1.558 . . . . 10.0 113.853 176.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 48' ' ' TYR . 2.9 t80 -148.97 118.0 6.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.257 1.023 . . . . 10.0 110.868 176.327 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.3 m -72.34 118.04 14.74 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.857 1.663 . . . . 10.0 111.088 176.35 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.701 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -127.89 177.19 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.371 1.868 . . . . 10.0 112.337 -175.639 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.6 p -77.65 142.66 38.73 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.282 -0.886 . . . . 10.0 111.788 168.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -65.11 -171.96 0.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.207 2.203 . . . . 10.0 112.769 163.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 59.1 -67.13 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.445 2.698 . . . . 10.0 112.093 -166.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -47.77 -31.73 5.17 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 130.209 3.404 . . . . 10.0 113.769 -179.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.701 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 27.4 mtmm -158.7 4.3 0.1 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 129.029 2.931 . . . . 10.0 112.467 -162.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.71 -62.48 1.37 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.672 0.789 . . . . 10.0 111.098 138.026 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -19.74 58.58 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.304 1.442 . . . . 10.0 114.812 -163.785 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.28 28.05 46.13 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-O 117.471 -1.738 . . . . 10.0 116.358 161.559 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 pp -54.98 20.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 130.346 3.458 . . . . 10.0 119.801 -167.418 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.2 m 55.64 99.27 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 128.865 2.866 . . . . 10.0 115.033 177.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -70.47 124.46 24.25 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.606 -0.684 . . . . 10.0 111.238 167.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt -163.86 170.18 17.18 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 129.565 3.146 . . . . 10.0 107.82 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -56.13 -33.61 65.33 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -60.86 -65.28 0.72 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.454 1.102 . . . . 10.0 111.887 171.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.0 p -62.69 -39.51 94.2 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.637 1.175 . . . . 10.0 111.981 -175.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.67 -16.99 59.39 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 174.954 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 29.0 mtm -68.27 -60.42 2.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.629 1.104 . . . . 10.0 108.741 160.566 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.63 -43.85 72.64 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.872 0.733 . . . . 10.0 111.006 -175.772 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -64.8 -54.97 22.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.151 -0.928 . . . . 10.0 113.07 178.038 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -26.09 65.37 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.741 1.61 . . . . 10.0 113.644 -178.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.46 -36.45 79.01 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.933 1.242 . . . . 10.0 112.614 171.153 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -161.58 96.01 1.3 Allowed Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.721 1.146 . . . . 10.0 112.594 169.638 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.67 -44.11 0.76 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.416 2.077 . . . . 10.0 111.098 -167.237 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -71.66 -24.08 61.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.092 1.757 . . . . 10.0 114.342 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -75.99 -40.11 54.47 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.886 1.221 . . . . 10.0 112.469 162.418 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -68.27 -41.06 81.62 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.258 0.836 . . . . 10.0 113.258 -176.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.47 156.96 69.29 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.244 1.018 . . . . 10.0 111.967 169.29 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.02 164.95 24.56 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.158 2.572 . . . . 10.0 114.833 -172.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.52 -77.43 0.09 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 127.157 2.313 . . . . 10.0 112.082 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m 58.8 -40.65 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 130.297 3.439 . . . . 10.0 118.954 164.266 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt 55.49 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 117.85 2.537 . . . . 10.0 117.85 174.629 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -64.59 79.52 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.054 1.742 . . . . 10.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tp -70.56 79.51 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.905 1.682 . . . . 10.0 111.395 178.096 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -161.12 -60.6 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 117.873 -1.061 . . . . 10.0 113.561 -176.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.14 91.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.931 2.197 . . . . 10.0 116.931 172.069 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.58 105.53 1.94 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 124.354 0.978 . . . . 10.0 111.285 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.5 tt -62.92 -56.3 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.439 0.903 . . . . 10.0 113.439 -165.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -162.34 -66.27 0.05 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.537 1.935 . . . . 10.0 111.111 174.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.9 mtmt -161.67 169.85 20.81 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.693 2.397 . . . . 10.0 107.886 -162.788 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -75.38 -11.35 60.03 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 -167.138 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.6 m -75.6 -56.17 4.95 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.942 1.247 . . . . 10.0 109.418 169.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -53.83 -36.79 62.93 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.819 2.047 . . . . 10.0 111.329 178.378 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -53.73 -46.11 70.74 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 126.833 2.053 . . . . 10.0 114.188 171.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -73.14 -45.12 58.55 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.112 0.965 . . . . 10.0 110.587 173.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -56.77 -49.23 75.92 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.781 1.232 . . . . 10.0 111.312 -170.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.1 -50.28 73.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.602 1.161 . . . . 10.0 112.538 174.365 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.8 mm -58.09 -47.18 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.182 0.993 . . . . 10.0 109.733 177.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.21 -47.32 85.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.585 1.154 . . . . 10.0 111.864 177.736 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -56.14 -56.79 16.61 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 118.661 -0.685 . . . . 10.0 112.081 173.375 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.69 -33.37 74.78 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.237 0.926 . . . . 10.0 112.484 -174.682 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -70.97 -23.58 62.24 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.381 1.252 . . . . 10.0 114.381 174.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -73.34 -59.23 2.81 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.687 -1.149 . . . . 10.0 110.825 159.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.86 -22.61 38.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 115.671 1.73 . . . . 10.0 115.671 -169.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 t -76.63 4.21 9.91 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.342 1.457 . . . . 10.0 114.582 169.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -150.37 -32.98 0.18 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.251 2.22 . . . . 10.0 112.925 -170.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 . . . . . 0 C--O 1.251 1.135 0 C-N-CA 127.595 2.358 . . . . 10.0 110.149 -156.93 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.988 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -156.67 170.94 21.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.941 1.371 . . . . 10.0 110.367 161.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.4 t -70.08 -67.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 126.267 1.827 . . . . 10.0 109.842 172.413 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -37.97 89.37 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.78 1.232 . . . . 10.0 112.509 179.74 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 mttp -73.17 4.56 4.31 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 118.094 -0.955 . . . . 10.0 113.422 168.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.63 -32.44 3.38 Favored Glycine 0 N--CA 1.472 1.036 0 CA-C-N 119.832 1.197 . . . . 10.0 114.505 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -29.72 65.4 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.791 1.796 . . . . 10.0 112.429 169.917 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.475 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.06 -15.73 63.31 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.372 1.619 . . . . 10.0 115.372 179.039 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.475 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 10.9 tp -110.46 -32.16 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.82 1.248 . . . . 10.0 111.252 170.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -54.61 -54.92 35.02 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 118.567 0.621 . . . . 10.0 110.088 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.32 -9.84 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.898 0.879 . . . . 10.0 112.673 -178.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -99.45 -35.81 9.78 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.26 1.824 . . . . 10.0 112.869 -173.348 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.42 -57.73 2.04 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.3 1.04 . . . . 10.0 111.709 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -56.52 -48.91 76.21 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.343 1.057 . . . . 10.0 112.24 -176.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.84 3.2 3.43 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.924 1.453 . . . . 10.0 114.924 174.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.37 -11.69 61.08 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 120.169 1.35 . . . . 10.0 111.854 162.089 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.18 -47.13 0.35 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.402 1.481 . . . . 10.0 112.33 -174.538 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -88.77 -170.71 3.03 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 127.194 2.197 . . . . 10.0 111.751 176.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.568 HG23 ' H ' ' A' ' 20' ' ' VAL . 5.1 t -131.52 -76.49 0.52 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.774 1.23 . . . . 10.0 113.666 -178.388 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.568 ' H ' HG23 ' A' ' 19' ' ' THR . 31.0 t 59.06 -60.46 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 129.925 3.29 . . . . 10.0 113.87 -174.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -128.35 -23.99 3.16 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 128.421 2.688 . . . . 10.0 110.52 -173.019 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -77.36 72.41 3.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.149 1.38 . . . . 10.0 110.681 168.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.27 0 C-N-CA 127.597 2.522 . . . . 10.0 115.613 169.797 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.1 m . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 115.74 1.755 . . . . 10.0 115.74 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.02 172.48 17.13 Favored Glycine 0 CA--C 1.544 1.889 0 C-N-CA 127.336 2.398 . . . . 10.0 111.885 160.549 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -75.87 -128.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.692 4.262 . . . . 10.0 110.725 175.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -144.76 -173.36 4.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.341 1.857 . . . . 10.0 109.784 -178.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.14 65.18 1.4 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 122.445 1.116 . . . . 10.0 109.497 175.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.31 77.06 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.16 2.584 . . . . 10.0 112.483 164.525 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.49 -58.31 0.3 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 128.976 3.179 . . . . 10.0 112.505 -172.387 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.263 0.1 OUTLIER 48.19 -106.54 0.17 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.658 2.383 . . . . 10.0 111.378 -165.516 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.327 9.6 m-85 33.86 39.7 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.171 2.988 . . . . 10.0 117.258 171.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 131.81 -16.08 5.08 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 126.82 2.153 . . . . 10.0 115.801 -175.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -64.23 -88.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.448 2.124 . . . . 10.0 113.967 -176.632 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.01 168.53 3.46 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 128.365 2.666 . . . . 10.0 111.641 163.159 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.7 p -67.53 163.26 21.52 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.448 2.299 . . . . 10.0 113.994 -177.755 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.75 9.37 81.21 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 117.979 1.952 . . . . 10.0 117.979 145.433 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -96.53 139.27 32.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.723 1.762 . . . . 10.0 113.199 -174.387 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.8 152.13 11.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.862 2.065 . . . . 10.0 108.741 160.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.24 67.97 8.43 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.987 2.458 . . . . 10.0 111.325 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.76 4.26 51.99 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 116.338 1.295 . . . . 10.0 116.338 169.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -70.1 175.04 4.79 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 119.173 1.486 . . . . 10.0 111.466 166.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -152.71 137.48 17.03 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.849 -1.157 . . . . 10.0 112.101 -174.753 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -156.66 169.42 24.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.591 2.356 . . . . 10.0 111.032 -153.715 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.8 p -64.86 122.95 18.14 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.026 0.83 . . . . 10.0 112.333 -172.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -35.55 71.28 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.716 1.376 . . . . 10.0 114.716 -159.495 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.73 -27.89 68.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -179.107 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -58.31 -62.66 1.67 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.082 0.953 . . . . 10.0 111.339 -175.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.445 ' H ' ' HD3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -45.79 -54.88 7.3 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.869 1.667 . . . . 10.0 110.189 177.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -65.96 -30.62 71.22 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.327 1.851 . . . . 10.0 114.51 -177.022 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -22.4 66.26 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 117.237 -1.363 . . . . 10.0 113.493 -179.135 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.04 -10.95 2.17 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 118.011 1.964 . . . . 10.0 118.011 154.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -15.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 128.521 2.728 . . . . 10.0 115.653 -178.28 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.9 m 58.39 128.48 0.01 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 131.201 3.8 . . . . 10.0 113.932 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -69.34 123.15 20.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.182 -0.917 . . . . 10.0 111.058 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.96 176.53 9.31 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 127.247 2.219 . . . . 10.0 109.466 -177.313 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -47.24 -26.87 1.31 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.79 2.836 . . . . 10.0 114.771 178.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -74.26 -71.27 0.34 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 10.0 112.519 167.194 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 56.8 p -75.37 -36.03 61.02 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 128.544 2.737 . . . . 10.0 112.074 -158.478 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.68 -21.28 59.49 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.571 1.148 . . . . 10.0 111.504 175.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.5 ttm -64.47 -53.95 40.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.153 0.581 . . . . 10.0 109.51 168.487 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -63.22 -46.89 84.89 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.595 0.559 . . . . 10.0 110.681 178.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.9 -48.04 72.79 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 113.331 0.863 . . . . 10.0 113.331 -174.314 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -17.93 59.79 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.638 1.563 . . . . 10.0 114.122 175.331 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -72.46 -33.3 66.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.989 1.722 . . . . 10.0 113.696 164.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.74 110.5 0.95 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 120.164 1.347 . . . . 10.0 113.713 158.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.19 -44.01 0.48 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.753 1.635 . . . . 10.0 112.174 -167.607 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.1 mtmp? -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.74 2.416 . . . . 10.0 113.259 178.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -70.55 -54.6 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.294 1.438 . . . . 10.0 109.368 172.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -72.81 -32.15 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.777 1.029 . . . . 10.0 113.777 -166.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 14.6 pt -137.11 143.89 43.85 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.069 0.948 . . . . 10.0 110.656 173.194 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.64 74.47 5.44 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.372 2.714 . . . . 10.0 112.941 -165.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.13 -100.72 0.18 Allowed Glycine 0 CA--C 1.524 0.611 0 C-N-CA 124.43 1.014 . . . . 10.0 111.554 166.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.8 m 51.04 93.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.03 2.532 . . . . 10.0 115.737 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -64.55 16.07 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 128.125 2.57 . . . . 10.0 115.271 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.5 ttt -69.76 90.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.302 1.441 . . . . 10.0 111.143 -178.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 81' ' ' ILE . 1.9 mp -66.34 69.58 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.607 1.963 . . . . 10.0 111.591 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -163.73 -42.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.943 1.697 . . . . 10.0 111.806 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.32 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 120.89 3.663 . . . . 10.0 120.89 178.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -166.39 147.09 11.61 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 121.427 1.922 . . . . 10.0 111.345 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.269 12.2 tt -71.23 -68.02 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.19 1.552 . . . . 10.0 115.19 -165.221 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.3 tttm -176.85 -51.25 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.156 1.782 . . . . 10.0 112.487 -179.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.479 ' HE3' ' HB ' ' A' ' 89' ' ' THR . 28.3 ttpt -164.24 146.87 9.12 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.947 2.099 . . . . 10.0 107.628 -160.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -58.84 -32.33 69.32 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 -176.146 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.479 ' HB ' ' HE3' ' A' ' 87' ' ' LYS . 4.9 m -61.67 -34.02 75.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.172 0.804 . . . . 10.0 113.172 174.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -76.3 -37.14 57.89 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.587 0.63 . . . . 10.0 111.73 171.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -55.15 -45.47 75.67 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.911 -1.118 . . . . 10.0 111.679 172.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -56.1 -53.89 51.58 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.623 1.169 . . . . 10.0 111.673 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -60.21 -34.87 74.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.528 0.731 . . . . 10.0 112.804 -169.079 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.49 -44.72 90.1 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.162 -0.961 . . . . 10.0 112.99 172.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.65 -46.82 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 109.158 -0.682 . . . . 10.0 109.158 177.624 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.76 -55.58 32.37 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.782 0.833 . . . . 10.0 111.903 173.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -50.68 -60.82 2.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.353 1.861 . . . . 10.0 112.505 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.9 -20.21 58.21 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.365 1.246 . . . . 10.0 114.365 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.445 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.6 OUTLIER -67.32 -29.35 68.89 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.166 1.348 . . . . 10.0 112.271 168.324 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -69.76 -39.73 76.53 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 117.674 -1.155 . . . . 10.0 112.24 165.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.86 -9.0 2.48 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 116.22 1.933 . . . . 10.0 116.22 -178.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 22.7 p -94.59 7.36 45.95 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.96 1.304 . . . . 10.0 114.016 167.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -150.68 -15.42 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.322 1.449 . . . . 10.0 113.495 -163.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 C--O 1.255 1.367 0 C-N-CA 130.21 3.404 . . . . 10.0 107.964 179.716 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 CA-C-O 119.71 -0.494 . . . . 10.0 112.356 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -86.94 103.13 15.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.221 1.408 . . . . 10.0 111.825 -163.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.7 m -60.54 -16.0 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 114.161 1.171 . . . . 10.0 114.161 -175.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -69.59 -59.6 2.86 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.873 2.069 . . . . 10.0 111.693 167.762 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -53.75 -27.79 30.69 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.842 0.857 . . . . 10.0 112.254 170.252 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.18 -47.76 12.46 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.699 1.142 . . . . 10.0 111.863 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.89 -39.9 79.51 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.397 1.099 . . . . 10.0 112.231 177.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -40.6 81.5 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.739 -1.6 . . . . 10.0 111.504 178.285 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.5 -33.61 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 121.559 1.981 . . . . 10.0 111.062 173.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -57.18 -53.78 54.24 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 118.854 0.752 . . . . 10.0 110.425 170.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.52 -10.34 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 N-CA-C 113.677 0.992 . . . . 10.0 113.677 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -96.81 -38.28 9.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.66 1.984 . . . . 10.0 111.598 -176.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -125.66 -17.35 5.51 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 115.031 1.493 . . . . 10.0 115.031 -172.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.0 m -112.49 -39.88 4.25 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 125.07 1.348 . . . . 10.0 112.235 -172.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.07 -17.31 9.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.743 0.645 . . . . 10.0 112.743 170.208 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.36 -29.07 32.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.061 1.744 . . . . 10.0 113.052 166.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.7 m -145.34 11.3 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 126.52 1.928 . . . . 10.0 114.983 -177.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -149.38 -178.3 6.34 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.106 1.321 . . . . 10.0 111.385 -177.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -150.91 172.76 15.16 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.357 -1.464 . . . . 10.0 108.071 151.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -166.09 -41.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.623 1.569 . . . . 10.0 111.869 162.365 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.81 82.71 0.11 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.729 0.812 . . . . 10.0 109.181 172.081 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 56.41 -174.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.883 2.073 . . . . 10.0 111.206 -166.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.613 0 N-CA-C 116.956 1.543 . . . . 10.0 116.956 170.373 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 116.123 1.897 . . . . 10.0 116.123 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.09 -176.4 14.4 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 120.168 1.349 . . . . 10.0 113.842 174.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.39 -2.59 12.63 Favored 'Trans proline' 0 CA--C 1.536 0.585 1 C-N-CA 125.978 4.452 . . . . 10.0 115.885 -175.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.421 0.1 OUTLIER 43.56 158.0 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.847 2.859 . . . . 10.0 117.336 -154.818 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.38 24.42 1.16 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 119.749 -1.844 . . . . 10.0 113.875 -167.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.457 ' CD2' HE21 ' A' ' 42' ' ' GLN . 0.2 OUTLIER -57.28 98.96 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 130.001 3.32 . . . . 10.0 114.436 -166.334 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.53 7.72 61.55 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.468 1.033 . . . . 10.0 114.378 176.557 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.49 178.4 0.42 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.115 1.458 . . . . 10.0 110.569 168.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.25 18.0 m-85 63.69 26.2 14.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 10.0 113.939 -159.068 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 176.61 15.11 0.02 OUTLIER Glycine 0 CA--C 1.536 1.39 0 C-N-CA 126.141 1.829 . . . . 10.0 114.716 -175.731 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -153.15 160.26 42.83 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.074 1.437 . . . . 10.0 111.304 -168.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.5 pttm -81.05 160.1 24.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.609 1.564 . . . . 10.0 112.762 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 t -58.47 150.07 23.54 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.082 -0.386 . . . . 10.0 110.354 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.24 63.6 0.8 Allowed Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.261 0.934 . . . . 10.0 112.138 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.457 HE21 ' CD2' ' A' ' 33' ' ' HIS . 13.3 pt20 -154.21 -19.49 0.13 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -177.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 136.15 96.59 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 119.169 0.895 . . . . 10.0 112.163 -168.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.91 72.96 5.0 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.631 2.887 . . . . 10.0 113.074 -168.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.01 2.37 52.24 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.77 1.468 . . . . 10.0 116.77 165.171 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.64 155.16 34.22 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 119.178 1.489 . . . . 10.0 111.163 175.433 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 m -71.72 74.87 0.84 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.341 1.456 . . . . 10.0 113.42 -176.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -83.67 172.88 11.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.752 1.621 . . . . 10.0 111.935 166.2 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.9 p -77.3 172.98 12.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 121.254 -0.904 . . . . 10.0 111.526 167.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -69.23 -63.28 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.095 -1.003 . . . . 10.0 111.392 169.288 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.8 -39.46 65.49 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.899 1.28 . . . . 10.0 113.92 -160.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -61.86 -38.44 88.25 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.678 0.791 . . . . 10.0 112.942 178.335 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.487 ' HE3' ' HA ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -77.19 -51.28 11.23 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.528 1.931 . . . . 10.0 110.701 173.834 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.36 -30.91 71.79 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.069 2.147 . . . . 10.0 113.32 -174.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 mmmm -159.99 16.58 0.14 Allowed 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.135 0.974 . . . . 10.0 113.391 -153.343 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.63 -133.61 0.67 Allowed Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.335 0.969 . . . . 10.0 111.878 163.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -170.23 -178.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.977 1.711 . . . . 10.0 110.521 -157.226 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 m -74.46 119.62 18.9 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.522 1.529 . . . . 10.0 111.194 172.437 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -77.14 62.07 2.16 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.461 1.504 . . . . 10.0 110.991 169.205 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -78.27 0.18 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 131.321 3.848 . . . . 10.0 115.643 -172.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 179.46 -9.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.992 2.917 . . . . 10.0 114.415 -176.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -81.82 -64.63 1.14 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.519 1.963 . . . . 10.0 112.857 160.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.8 p -54.74 -35.79 64.11 Favored 'General case' 0 N--CA 1.467 0.388 1 C-N-CA 132.078 4.151 . . . . 10.0 114.913 -165.613 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.6 mp -69.99 -24.56 63.33 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 117.606 -1.187 . . . . 10.0 113.103 175.327 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -41.91 68.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 120.55 1.523 . . . . 10.0 109.425 175.741 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -46.61 78.33 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.418 -0.513 . . . . 10.0 110.336 172.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -67.64 -43.6 79.93 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.711 1.004 . . . . 10.0 113.711 -174.712 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.35 -34.36 74.47 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.884 1.675 . . . . 10.0 112.572 177.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -76.36 -25.77 55.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.494 0.718 . . . . 10.0 112.694 177.147 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.58 74.63 2.11 Favored Pre-proline 0 CA--C 1.559 1.296 0 N-CA-C 113.275 0.842 . . . . 10.0 113.275 -178.25 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.29 -50.13 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.887 2.391 . . . . 10.0 112.487 -166.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -66.85 -22.26 65.99 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.798 1.639 . . . . 10.0 113.689 -178.747 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -75.41 -53.33 8.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.327 1.051 . . . . 10.0 110.274 166.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.34 -38.46 91.22 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.465 0.913 . . . . 10.0 113.465 -172.601 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.0 pt -131.69 117.72 16.48 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.773 0.829 . . . . 10.0 110.767 171.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.19 104.37 1.66 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.574 2.85 . . . . 10.0 111.798 -172.1 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.68 82.31 1.62 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.032 0.825 . . . . 10.0 111.594 178.189 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -133.22 -19.38 2.2 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.253 1.946 . . . . 10.0 116.253 -169.812 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 55.47 2.29 0.06 Allowed 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 117.039 2.236 . . . . 10.0 117.039 173.461 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.2 ttt -62.93 81.45 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 120.302 1.41 . . . . 10.0 110.081 161.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.49 90.26 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.956 1.303 . . . . 10.0 109.359 176.063 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -161.6 -68.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 118.32 -0.848 . . . . 10.0 112.825 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.17 89.08 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 127.237 2.215 . . . . 10.0 116.527 172.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.38 92.56 2.05 Favored Glycine 0 CA--C 1.532 1.101 0 O-C-N 121.691 -0.631 . . . . 10.0 113.179 175.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 17.8 tt -64.38 -36.82 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 115.808 1.781 . . . . 10.0 115.808 -167.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttm 164.41 -165.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 129.413 3.085 . . . . 10.0 108.501 -161.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.51 ' HE2' ' HG2' ' A' ' 90' ' ' GLU . 40.8 pttt -52.63 153.32 3.19 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.973 1.709 . . . . 10.0 110.91 167.088 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -73.16 71.45 1.16 Allowed 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 123.325 1.536 . . . . 10.0 110.774 171.656 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.3 m -151.89 -54.34 0.13 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 125.903 1.681 . . . . 10.0 108.259 169.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG2' ' HE2' ' A' ' 87' ' ' LYS . 18.6 mm-40 -56.7 -38.83 72.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.762 0.71 . . . . 10.0 111.313 172.47 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -30.98 71.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.153 0.581 . . . . 10.0 111.907 174.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.05 -36.08 61.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.068 0.947 . . . . 10.0 111.239 173.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.59 -48.08 70.69 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.646 1.978 . . . . 10.0 111.186 175.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.23 -53.91 30.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.949 2.1 . . . . 10.0 112.668 174.681 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.26 -38.88 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 122.781 0.432 . . . . 10.0 110.274 -178.763 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.7 99.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 122.525 0.33 . . . . 10.0 111.647 173.375 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.401 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -56.6 -60.85 2.93 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.476 1.11 . . . . 10.0 111.195 172.287 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 60.2 mt -61.04 -36.78 80.48 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.543 1.065 . . . . 10.0 112.728 -175.626 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.91 -32.57 61.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 117.891 -1.052 . . . . 10.0 112.721 174.478 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -101.13 -35.79 9.19 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 175.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.61 -27.53 64.77 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.969 1.713 . . . . 10.0 113.506 -178.262 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.9 t -65.38 -11.65 44.4 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.835 1.254 . . . . 10.0 114.363 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.71 51.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.031 2.132 . . . . 10.0 111.029 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 113.388 0.885 . . . . 10.0 113.388 172.026 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.29 119.88 19.25 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.814 1.246 . . . . 10.0 110.501 -161.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.472 HG23 ' HA ' ' A' ' 97' ' ' TYR . 7.3 p -56.24 -34.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 O-C-N 121.48 -0.763 . . . . 10.0 111.294 172.482 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.2 mp0 -60.72 -48.02 83.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 126.528 1.931 . . . . 10.0 111.164 -171.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mtmp? -75.68 -23.64 56.23 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.069 1.748 . . . . 10.0 113.568 167.579 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.27 -46.42 7.54 Favored Glycine 0 N--CA 1.464 0.555 0 O-C-N 121.236 -0.915 . . . . 10.0 111.78 -168.54 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -41.48 50.79 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.923 1.289 . . . . 10.0 113.408 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -71.72 -37.86 70.57 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.709 -1.139 . . . . 10.0 113.763 179.228 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.27 -35.61 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 120.372 1.442 . . . . 10.0 109.996 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.436 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 32.6 t80 -57.08 -51.11 70.61 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.222 0.919 . . . . 10.0 110.624 173.606 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.22 -16.63 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 113.968 1.099 . . . . 10.0 113.968 177.033 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.2 -34.76 25.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.535 1.134 . . . . 10.0 111.953 -173.768 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -136.53 -58.95 0.73 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.799 1.639 . . . . 10.0 110.334 -163.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 8.9 m -58.45 -45.9 87.64 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.806 1.243 . . . . 10.0 111.999 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -8.78 17.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.713 1.375 . . . . 10.0 114.713 175.497 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -10.22 59.48 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.01 -1.056 . . . . 10.0 112.412 169.774 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 87.3 m -142.87 -27.55 0.58 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -173.024 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -116.72 168.12 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.333 2.253 . . . . 10.0 112.956 -176.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -136.07 137.78 41.45 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.859 1.263 . . . . 10.0 109.855 165.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.2 p -166.26 -32.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.923 1.289 . . . . 10.0 111.738 172.364 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -48.21 -38.06 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.36 2.264 . . . . 10.0 115.311 175.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.46 148.47 16.38 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.489 1.916 . . . . 10.0 108.14 168.346 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.197 0 CA-C-O 121.583 0.546 . . . . 10.0 112.05 -172.336 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.472 0.653 0 CA-C-O 118.873 -0.584 . . . . 10.0 111.604 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.97 167.06 22.97 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 109.782 -1.327 . . . . 10.0 109.782 149.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.0 155.49 52.78 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 10.0 112.135 179.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.69 129.68 40.73 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.068 -1.02 . . . . 10.0 109.82 165.543 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.32 70.36 2.92 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.571 1.653 . . . . 10.0 112.592 -167.311 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.65 88.61 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.583 1 C-N-CA 132.576 4.35 . . . . 10.0 115.112 -178.931 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.58 27.23 70.62 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.245 0.926 . . . . 10.0 114.938 162.652 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.5 mp -53.37 166.06 0.31 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.834 1.654 . . . . 10.0 111.905 178.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 29.1 m-85 65.36 59.37 0.8 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.007 1.723 . . . . 10.0 113.246 -174.067 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 161.35 -46.01 0.38 Allowed Glycine 0 CA--C 1.53 0.986 0 CA-C-N 115.533 -0.758 . . . . 10.0 114.187 167.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.11 169.51 13.06 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.976 0.91 . . . . 10.0 112.13 177.086 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.1 pttm -74.74 -20.52 59.79 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 115.055 1.502 . . . . 10.0 115.055 -165.828 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.453 HG21 ' H ' ' A' ' 59' ' ' TRP 0.288 29.6 p 88.05 167.5 0.06 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 129.417 3.087 . . . . 10.0 112.659 175.449 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 70.21 116.77 0.04 OUTLIER Glycine 0 CA--C 1.541 1.664 0 C-N-CA 123.109 0.385 . . . . 10.0 112.217 -154.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -159.45 4.87 0.09 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.393 1.877 . . . . 10.0 113.861 168.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -50.86 108.98 1.16 Allowed Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 125.966 1.707 . . . . 10.0 114.651 -164.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.6 65.61 8.09 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.386 3.391 . . . . 10.0 112.944 -171.459 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 107.64 60.26 0.56 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.798 1.19 . . . . 10.0 113.171 174.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -143.81 169.66 17.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.182 1.393 . . . . 10.0 109.607 177.286 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -153.25 151.79 30.44 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.585 0.754 . . . . 10.0 110.772 177.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.402 ' CD2' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -157.76 -92.89 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 10.0 111.22 -153.899 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -145.8 -1.64 0.77 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.129 2.172 . . . . 10.0 114.106 -177.006 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 45.46 -95.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.923 2.089 . . . . 10.0 112.613 -157.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 30.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.697 3.199 . . . . 10.0 115.558 170.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -43.95 -56.61 3.82 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.782 2.033 . . . . 10.0 111.695 174.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.402 ' HE3' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -62.01 -40.09 94.49 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.263 1.825 . . . . 10.0 111.087 -177.397 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -63.41 -48.6 77.13 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.227 1.411 . . . . 10.0 111.533 176.259 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -62.18 -24.09 66.99 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.714 1.206 . . . . 10.0 113.701 -174.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.4 36.66 93.68 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.375 0.989 . . . . 10.0 114.184 171.083 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -1.44 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.869 2.067 . . . . 10.0 116.084 -174.486 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.8 m 56.27 92.59 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.606 1.963 . . . . 10.0 113.184 -179.689 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.453 ' H ' HG21 ' A' ' 40' ' ' THR . 10.5 m95 -58.68 125.75 24.75 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.427 168.954 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.424 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 0.6 OUTLIER -162.76 178.62 8.31 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.782 2.833 . . . . 10.0 109.177 -178.237 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -67.17 35.36 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 129.637 3.175 . . . . 10.0 114.574 -172.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -160.89 -63.8 0.06 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 127.904 2.482 . . . . 10.0 108.432 -174.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.5 p -57.92 -46.93 84.25 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.116 1.366 . . . . 10.0 111.673 179.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.44 -29.09 66.72 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.563 1.145 . . . . 10.0 111.783 175.519 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 30.3 ttm -68.77 -43.69 75.24 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 118.275 0.489 . . . . 10.0 111.105 175.663 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -67.91 -45.79 73.37 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 117.908 0.322 . . . . 10.0 110.184 173.305 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.5 -57.72 11.53 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 118.107 -0.949 . . . . 10.0 112.45 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -34.05 76.72 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.549 1.522 . . . . 10.0 111.904 -174.573 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -73.02 -22.05 60.72 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.634 1.716 . . . . 10.0 115.634 175.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -161.47 63.15 1.61 Allowed Pre-proline 0 CA--C 1.556 1.189 0 CA-C-N 120.156 1.344 . . . . 10.0 114.384 178.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.208 1.939 . . . . 10.0 113.072 -159.18 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -71.17 -20.47 62.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.703 2.001 . . . . 10.0 112.745 -178.248 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.23 -51.99 10.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.521 1.129 . . . . 10.0 110.231 164.149 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -60.49 -44.99 95.37 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.87 1.063 . . . . 10.0 113.87 -173.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 pt -137.08 124.35 14.07 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.992 . . . . 10.0 110.436 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -78.07 60.24 7.28 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.407 3.405 . . . . 10.0 112.696 -167.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.85 66.38 0.04 OUTLIER Glycine 0 CA--C 1.523 0.584 0 O-C-N 121.567 -0.708 . . . . 10.0 113.338 179.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 4.5 m -135.91 125.35 25.0 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.886 0.874 . . . . 10.0 111.871 173.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -86.39 -3.53 59.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.783 1.401 . . . . 10.0 114.783 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.1 ttt -50.11 101.83 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.972 1.709 . . . . 10.0 113.7 -174.816 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 27.3 mm -78.22 72.96 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.224 1.41 . . . . 10.0 109.583 175.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -163.58 -49.42 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.851 1.26 . . . . 10.0 111.139 169.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.93 32.53 1.35 Allowed 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 118.081 2.623 . . . . 10.0 118.081 164.52 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 179.0 -161.11 27.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.965 1.269 . . . . 10.0 111.441 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.2 tt -147.68 -175.37 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.554 0.742 . . . . 10.0 111.71 165.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -77.89 -30.47 50.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.939 1.296 . . . . 10.0 114.492 -164.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -161.63 -68.96 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 116.588 -1.672 . . . . 10.0 111.755 -170.069 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 pttm 174.98 -40.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.777 2.031 . . . . 10.0 115.815 164.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 m -58.39 -30.3 66.71 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.732 1.606 . . . . 10.0 112.04 -178.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.3 mp0 -59.42 -29.08 67.5 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.23 -0.919 . . . . 10.0 112.366 173.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -67.13 -55.57 13.66 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 119.189 0.904 . . . . 10.0 111.63 -178.476 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -61.06 -34.67 75.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.933 1.293 . . . . 10.0 111.618 175.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -67.33 -45.9 75.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.145 0.884 . . . . 10.0 112.545 174.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.14 -38.36 90.36 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.334 -0.854 . . . . 10.0 113.019 174.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mt -61.16 -51.21 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 118.566 -0.73 . . . . 10.0 109.6 170.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -41.64 85.31 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.876 0.762 . . . . 10.0 112.557 177.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.472 ' HA ' HG23 ' A' ' 3' ' ' VAL . 2.7 t80 -50.36 -65.73 0.51 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 124.407 1.083 . . . . 10.0 111.557 169.414 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.4 -36.01 82.3 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.491 0.587 . . . . 10.0 112.131 -175.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -65.75 -21.61 66.53 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.423 1.489 . . . . 10.0 114.263 176.029 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -87.79 -52.56 5.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.466 1.03 . . . . 10.0 111.422 160.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -26.05 52.97 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 -170.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.556 HG23 HD22 ' A' ' 103' ' ' ASN . 4.5 t -74.11 -1.86 22.03 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.42 1.488 . . . . 10.0 114.126 172.674 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.556 HD22 HG23 ' A' ' 102' ' ' THR . 7.1 p30 -154.08 -18.61 0.13 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 117.12 2.267 . . . . 10.0 117.12 -178.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.074 -1.917 . . . . 10.0 114.561 177.952 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 CA-C-O 118.828 -0.984 . . . . 10.0 111.347 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -140.74 160.12 40.73 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.287 1.588 . . . . 10.0 115.287 -149.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.17 -53.0 54.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 125.817 1.647 . . . . 10.0 112.749 -179.22 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -44.45 97.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.786 1.176 . . . . 10.0 113.335 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -56.13 -36.22 68.0 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.675 0.75 . . . . 10.0 110.793 172.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.37 -51.42 6.7 Favored Glycine 0 C--O 1.224 -0.512 0 C-N-CA 125.248 1.404 . . . . 10.0 110.288 -173.724 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -37.52 83.38 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.111 1.456 . . . . 10.0 112.637 177.248 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -59.94 -56.79 17.33 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.625 0.77 . . . . 10.0 111.594 174.724 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -31.76 47.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 118.438 0.563 . . . . 10.0 111.816 -178.45 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -56.41 -51.08 69.69 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.371 -1.455 . . . . 10.0 110.576 168.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.68 -15.53 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 113.682 0.993 . . . . 10.0 113.682 178.375 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -90.09 -43.6 10.38 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.025 1.33 . . . . 10.0 111.78 -179.631 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -119.2 -11.37 9.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.932 1.456 . . . . 10.0 114.932 -169.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -120.32 -44.17 2.49 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.451 1.5 . . . . 10.0 111.434 -172.345 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.31 -11.17 20.03 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.696 0.998 . . . . 10.0 113.696 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.25 -25.95 26.18 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.953 2.101 . . . . 10.0 112.553 164.04 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.8 m -141.68 -19.29 0.75 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 10.0 113.629 -173.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.43 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 92.3 m-70 -130.25 86.16 2.37 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 10.0 110.897 -177.067 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.2 p -69.69 18.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.574 2.064 . . . . 10.0 116.574 -167.467 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.71 -35.07 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 O-C-N 120.642 -1.286 . . . . 10.0 113.509 -160.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -62.99 -0.84 0.76 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.131 1.772 . . . . 10.0 114.271 177.077 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -150.28 13.68 0.77 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.109 2.164 . . . . 10.0 111.561 178.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.126 0 C-N-CA 125.137 1.351 . . . . 10.0 112.312 -169.686 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.477 0.925 0 CA-C-O 118.254 -0.879 . . . . 10.0 113.248 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.43 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -124.98 170.99 16.95 Favored Glycine 0 CA--C 1.54 1.653 0 CA-C-N 119.657 1.117 . . . . 10.0 111.95 167.125 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.24 44.18 1.6 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 124.908 3.739 . . . . 10.0 113.969 -153.197 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 48.14 18.84 0.16 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.172 2.189 . . . . 10.0 115.963 -178.378 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt 33.37 64.6 0.3 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.964 2.905 . . . . 10.0 112.835 -179.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -54.11 80.48 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.83 2.452 . . . . 10.0 111.748 172.098 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.04 -47.89 0.07 OUTLIER Glycine 0 CA--C 1.536 1.358 0 C-N-CA 129.827 3.584 . . . . 10.0 116.237 -179.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.276 8.6 mp 53.78 -148.8 0.44 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.533 1.933 . . . . 10.0 110.295 -165.67 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 34.8 59.52 0.68 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.148 2.179 . . . . 10.0 114.959 178.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 115.81 -27.2 8.43 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.693 2.092 . . . . 10.0 113.17 -174.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -69.49 74.26 0.38 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.071 1.348 . . . . 10.0 111.344 170.087 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt 34.03 -125.25 0.09 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 129.927 3.291 . . . . 10.0 113.776 161.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.41 HG22 ' HA ' ' A' ' 53' ' ' LYS . 3.7 m -149.52 -79.62 0.13 Allowed 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.163 -1.585 . . . . 10.0 109.742 171.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.59 88.47 0.73 Allowed Glycine 0 CA--C 1.535 1.296 0 O-C-N 120.357 -1.464 . . . . 10.0 115.541 179.816 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -134.4 9.53 3.72 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.452 1.279 . . . . 10.0 114.452 -178.085 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.8 140.34 93.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 121.031 -1.043 . . . . 10.0 112.266 -176.735 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -77.61 52.34 3.91 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 124.104 3.203 . . . . 10.0 112.876 -177.382 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.88 -96.49 0.37 Allowed Glycine 0 CA--C 1.527 0.785 0 C-N-CA 126.347 1.927 . . . . 10.0 110.869 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.7 t80 32.8 100.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.758 2.823 . . . . 10.0 117.234 165.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 m -66.33 90.25 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.168 -0.957 . . . . 10.0 112.258 168.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -83.13 174.0 11.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.298 1.439 . . . . 10.0 110.447 161.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.0 p -74.42 30.88 0.08 Allowed 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -174.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.5 t70 45.73 -69.02 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 129.849 3.259 . . . . 10.0 115.593 -166.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.04 -45.73 61.4 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.026 1.73 . . . . 10.0 113.552 -150.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -45.9 -70.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.38 1.472 . . . . 10.0 111.748 171.323 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.41 ' HA ' HG22 ' A' ' 40' ' ' THR . 18.9 mtpp -71.19 -25.37 62.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.581 1.552 . . . . 10.0 112.447 -171.197 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.56 -45.93 92.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.51 1.524 . . . . 10.0 112.697 161.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.71 -24.13 65.35 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.27 0.941 . . . . 10.0 113.184 -170.198 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.77 26.9 70.19 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-O 119.1 -0.833 . . . . 10.0 115.072 163.46 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -3.96 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 115.847 1.795 . . . . 10.0 115.847 -171.615 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.4 m 57.86 108.9 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.565 2.346 . . . . 10.0 114.002 -170.551 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -67.24 119.76 12.67 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.284 -0.871 . . . . 10.0 112.349 173.067 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -166.63 -175.92 3.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.742 2.817 . . . . 10.0 108.768 175.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -45.59 -53.08 9.63 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.645 1.578 . . . . 10.0 111.635 176.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.67 15.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.862 2.065 . . . . 10.0 116.047 -174.833 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.9 p -157.73 -39.26 0.07 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.94 -1.1 . . . . 10.0 110.879 -169.221 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -30.19 59.65 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.181 1.355 . . . . 10.0 112.787 174.841 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -51.03 58.46 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 119.613 1.097 . . . . 10.0 108.616 174.743 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.81 -37.74 87.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.506 0.722 . . . . 10.0 110.653 -179.807 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -66.06 -65.38 0.68 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.403 -0.808 . . . . 10.0 112.561 173.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -17.26 64.71 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.818 1.645 . . . . 10.0 114.301 -172.756 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.93 -32.05 71.38 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.806 1.185 . . . . 10.0 113.557 165.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -163.23 79.31 1.67 Allowed Pre-proline 0 CA--C 1.549 0.933 0 CA-C-N 119.754 1.161 . . . . 10.0 111.642 177.262 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.36 -52.25 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.189 1.926 . . . . 10.0 110.873 -163.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -67.78 24.88 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.767 2.827 . . . . 10.0 114.568 -177.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.91 -28.8 0.06 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.921 2.089 . . . . 10.0 111.894 -175.081 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -64.62 -38.6 91.56 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 119.273 0.942 . . . . 10.0 112.006 165.376 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.4 pt -133.78 151.08 76.34 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 124.239 1.016 . . . . 10.0 111.381 176.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.1 162.2 41.36 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.725 2.284 . . . . 10.0 111.213 173.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 39.7 61.85 1.51 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.955 1.74 . . . . 10.0 114.775 172.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.9 t -121.08 -14.41 8.41 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.101 1.519 . . . . 10.0 115.101 178.198 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? 54.5 -67.14 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 127.668 2.387 . . . . 10.0 116.071 179.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.1 ttt 13.53 85.17 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 130.961 3.704 . . . . 10.0 113.838 -177.15 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -70.53 80.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.856 1.263 . . . . 10.0 109.553 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -162.95 -51.83 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.455 1.502 . . . . 10.0 111.19 172.086 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 35.15 57.6 0.79 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.845 2.458 . . . . 10.0 116.449 170.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 161.41 -166.96 36.11 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.457 1.027 . . . . 10.0 111.594 179.446 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 tt -158.08 178.15 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.826 1.65 . . . . 10.0 109.475 166.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -88.9 166.96 13.61 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.844 1.202 . . . . 10.0 111.047 178.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . 0.258 8.6 ptpp? 40.21 -103.53 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.602 1.961 . . . . 10.0 112.153 -172.522 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.2 tttp -163.17 -32.95 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.828 1.251 . . . . 10.0 112.578 154.003 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.9 m -59.06 -21.39 59.09 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 -178.882 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -54.64 -32.77 59.57 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.067 -1.021 . . . . 10.0 112.354 167.444 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.35 -22.36 61.17 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.226 1.411 . . . . 10.0 112.744 175.423 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.26 -53.91 7.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.238 1.015 . . . . 10.0 110.402 164.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.65 1.58 . . . . 10.0 111.735 -169.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 mp -53.69 -42.95 68.52 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 114.499 1.296 . . . . 10.0 114.499 173.668 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.8 mm -66.09 -50.86 66.06 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.238 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.132 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.42 66.28 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.916 -1.04 . . . . 10.0 113.301 179.471 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -66.51 -69.2 0.32 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.67 1.988 . . . . 10.0 112.557 159.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.79 -20.6 63.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.085 0.772 . . . . 10.0 113.085 -173.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.17 -35.52 62.4 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.883 2.073 . . . . 10.0 113.371 166.815 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -81.27 -46.0 15.42 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.037 1.335 . . . . 10.0 110.874 171.399 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.2 -1.02 0.27 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.453 2.39 . . . . 10.0 117.453 -166.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.7 t -133.85 15.42 3.94 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.838 1.255 . . . . 10.0 114.227 168.4 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -151.02 -13.48 0.22 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.767 1.627 . . . . 10.0 114.172 -169.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.949 1.699 . . . . 10.0 114.25 177.214 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.942 0 CA-C-O 117.914 -1.492 . . . . 10.0 111.792 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -139.53 164.59 29.48 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.119 1.459 . . . . 10.0 114.823 -173.601 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.4 t -75.29 -61.22 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 126.281 1.832 . . . . 10.0 109.879 165.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -60.0 -47.36 86.14 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.986 -1.071 . . . . 10.0 113.531 -175.236 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -59.16 -31.47 69.01 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 117.871 0.305 . . . . 10.0 111.226 172.918 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.23 -50.94 19.82 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 125.858 1.694 . . . . 10.0 111.379 178.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -32.7 74.36 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 117.879 0.84 . . . . 10.0 111.813 -179.337 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -63.26 -55.2 26.84 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.802 1.241 . . . . 10.0 111.413 173.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.251 0.2 OUTLIER -68.3 -30.17 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 CA-C-N 118.473 0.579 . . . . 10.0 111.747 -179.474 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -56.35 -54.06 49.93 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 120.468 -1.395 . . . . 10.0 110.83 164.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.2 t -62.23 -13.93 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 O-C-N 121.308 -0.87 . . . . 10.0 113.209 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -91.93 -42.16 10.19 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.641 1.177 . . . . 10.0 112.285 178.508 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -124.44 -3.06 7.93 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.63 1.715 . . . . 10.0 115.63 -168.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.7 m -120.67 -43.9 2.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.909 1.684 . . . . 10.0 111.0 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.64 -4.37 8.62 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.493 1.294 . . . . 10.0 114.493 176.304 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.47 -12.38 60.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.64 1.176 . . . . 10.0 113.964 164.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.63 -40.57 0.29 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.622 1.569 . . . . 10.0 112.49 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.468 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.5 m-70 -93.68 -161.61 0.86 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 127.504 2.322 . . . . 10.0 109.034 166.246 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 m -154.8 -55.07 0.1 Allowed 'General case' 0 N--CA 1.482 1.175 0 O-C-N 119.847 -1.783 . . . . 10.0 112.574 165.281 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t 61.2 -71.75 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.085 1.754 . . . . 10.0 114.422 177.568 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.35 -52.75 64.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.342 1.057 . . . . 10.0 111.769 -166.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -153.17 100.27 2.45 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.953 1.301 . . . . 10.0 110.582 -171.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.255 0 N-CA-C 117.003 1.561 . . . . 10.0 117.003 165.505 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.468 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -148.89 156.61 26.92 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-N 120.681 1.582 . . . . 10.0 112.328 167.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.99 3.91 3.6 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 124.79 3.66 . . . . 10.0 117.088 -151.04 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 64.32 149.12 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.482 2.713 . . . . 10.0 112.654 -144.646 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -83.54 50.0 1.7 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.647 1.179 . . . . 10.0 110.691 176.135 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.46 98.45 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 128.267 2.627 . . . . 10.0 113.821 -173.92 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 17.96 68.02 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.562 1.077 . . . . 10.0 114.651 173.894 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -61.06 172.28 1.05 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 118.914 1.357 . . . . 10.0 112.015 179.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.281 77.5 m-85 71.38 68.25 0.16 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.395 1.878 . . . . 10.0 111.614 -163.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.2 -23.45 5.19 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 126.731 2.11 . . . . 10.0 113.215 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mtp85 -77.68 162.51 26.95 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.401 1.096 . . . . 10.0 112.557 173.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HD2' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -73.75 179.02 4.42 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.459 2.304 . . . . 10.0 111.765 171.74 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.3 p -73.82 174.87 7.86 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.295 1.038 . . . . 10.0 109.439 161.294 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.39 -179.37 37.52 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-O 121.788 0.66 . . . . 10.0 111.717 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 65.32 166.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.563 1.945 . . . . 10.0 114.696 -176.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 162.36 167.38 0.05 OUTLIER Pre-proline 0 CA--C 1.546 0.824 1 C-N-CA 133.216 4.607 . . . . 10.0 105.212 -169.222 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.77 -143.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.55 1.318 0 C-N-CA 122.538 2.159 . . . . 10.0 108.927 146.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.88 18.94 0.17 Allowed Glycine 0 CA--C 1.544 1.862 0 N-CA-C 117.447 1.739 . . . . 10.0 117.447 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -77.35 106.06 8.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.443 1.622 . . . . 10.0 110.893 175.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 m -65.61 138.64 58.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.13 1.372 . . . . 10.0 111.567 173.435 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.452 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.46 -178.94 6.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.519 1.528 . . . . 10.0 112.3 -175.126 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.3 p -71.78 164.35 26.15 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.203 0.601 . . . . 10.0 111.805 167.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -75.48 -111.24 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.236 -0.915 . . . . 10.0 109.847 163.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 35.81 -87.34 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 130.086 3.354 . . . . 10.0 115.051 168.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -45.82 -56.97 4.7 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.209 1.403 . . . . 10.0 112.738 170.428 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -63.5 -35.78 81.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.227 0.611 . . . . 10.0 111.27 -175.71 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.21 -43.76 85.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.643 2.377 . . . . 10.0 113.417 172.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -21.94 55.09 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.851 1.797 . . . . 10.0 115.851 -167.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.06 -7.54 63.08 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 116.24 1.256 . . . . 10.0 116.24 159.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.6 pp -56.77 141.71 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 118.61 1.205 . . . . 10.0 111.966 -177.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.8 m -67.83 117.9 10.34 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 121.641 -0.662 . . . . 10.0 110.013 -178.288 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -71.18 113.55 8.33 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 170.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.62 179.52 7.14 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 10.0 111.887 -168.642 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -69.74 42.91 0.05 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.279 1.831 . . . . 10.0 115.207 -172.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -160.23 -66.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.132 2.173 . . . . 10.0 108.254 -176.372 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.0 p -57.22 -38.24 73.45 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 126.594 1.958 . . . . 10.0 112.731 -179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.57 -23.25 56.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 10.0 113.035 176.772 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -51.91 30.63 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.151 1.341 . . . . 10.0 108.466 169.454 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.2 -43.72 98.43 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 123.431 0.457 . . . . 10.0 110.315 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.61 -57.88 10.83 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 118.304 -0.855 . . . . 10.0 111.931 175.298 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.76 -28.79 67.11 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 120.288 1.404 . . . . 10.0 113.645 -172.114 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -78.88 -19.58 51.58 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.521 1.304 . . . . 10.0 114.521 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.4 60.73 1.43 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.37 1.068 . . . . 10.0 110.856 -167.681 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.95 -58.85 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.519 2.146 . . . . 10.0 111.343 -168.142 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -70.63 38.2 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 129.034 2.934 . . . . 10.0 113.174 179.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.07 -49.52 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 128.391 2.676 . . . . 10.0 108.828 -169.391 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -62.18 -36.78 82.92 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.907 0.321 . . . . 10.0 111.539 174.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.82 154.59 73.01 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 126.163 1.785 . . . . 10.0 108.72 166.122 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.43 164.81 34.52 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 121.65 1.566 . . . . 10.0 110.425 165.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.32 66.84 2.33 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.184 -0.787 . . . . 10.0 114.208 168.356 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -129.49 -33.26 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.786 1.773 . . . . 10.0 115.786 172.68 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 62.78 -63.26 0.11 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 116.954 -1.498 . . . . 10.0 113.889 -170.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.1 ttt 10.27 91.29 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 129.715 3.206 . . . . 10.0 114.512 -173.098 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 19.9 mm -72.51 74.2 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 125.376 1.47 . . . . 10.0 110.895 -175.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -163.29 -49.46 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.615 1.566 . . . . 10.0 112.101 169.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.83 78.62 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.717 2.407 . . . . 10.0 115.576 172.876 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.62 -159.48 25.86 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.206 1.384 . . . . 10.0 112.916 -176.675 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.9 tt -153.84 -178.66 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.376 1.47 . . . . 10.0 109.812 157.046 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -76.36 -87.2 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.804 1.242 . . . . 10.0 114.003 -166.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -65.74 0.9 Allowed 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.669 1.577 . . . . 10.0 111.342 -176.107 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.6 pttt 174.57 -61.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.905 2.482 . . . . 10.0 111.721 176.574 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.4 m -59.46 -20.72 57.36 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 -173.209 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -56.3 -26.99 54.06 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.081 0.855 . . . . 10.0 112.529 168.485 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -50.07 75.21 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 125.025 1.33 . . . . 10.0 110.898 172.285 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -62.72 -48.36 79.58 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.052 1.341 . . . . 10.0 110.222 176.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -59.88 -48.62 80.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.516 1.126 . . . . 10.0 111.773 -172.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mp -54.99 -49.64 70.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.19 0.811 . . . . 10.0 113.19 173.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.2 mm -62.67 -45.76 98.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 123.264 0.625 . . . . 10.0 109.69 -178.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.88 -46.86 86.84 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.817 1.247 . . . . 10.0 112.236 174.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.12 -59.95 4.19 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.875 0.87 . . . . 10.0 111.273 173.988 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.24 -37.95 89.3 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -173.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -62.06 -24.45 67.1 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.04 0.936 . . . . 10.0 112.852 176.956 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.51 -59.06 2.49 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.517 1.527 . . . . 10.0 111.896 165.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.61 -32.52 63.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.63 1.572 . . . . 10.0 114.588 -171.361 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -54.61 -32.27 58.52 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 174.845 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -87.93 -20.3 26.11 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.171 1.388 . . . . 10.0 114.372 177.957 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 116.128 -1.892 . . . . 10.0 112.939 -140.714 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 110.063 -1.215 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.503 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.7 OUTLIER -134.03 96.17 3.58 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.231 1.413 . . . . 10.0 107.447 -152.579 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.9 p -49.49 -39.02 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.679 1.592 . . . . 10.0 113.853 -162.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 53.4 mp0 -71.13 -32.65 69.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.85 1.26 . . . . 10.0 113.987 178.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.3 mttt -75.68 -28.31 58.61 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 125.252 1.421 . . . . 10.0 111.436 174.53 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.61 -42.42 93.45 Favored Glycine 0 C--N 1.334 0.462 0 N-CA-C 109.951 -1.26 . . . . 10.0 109.951 -173.36 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -62.87 -41.52 99.42 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.85 0.685 . . . . 10.0 112.85 173.099 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -62.21 -54.86 34.84 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.812 1.645 . . . . 10.0 111.323 179.406 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 tp -69.23 -33.4 57.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 122.637 0.375 . . . . 10.0 111.577 -179.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -57.67 -49.7 75.61 Favored 'General case' 0 C--N 1.344 0.356 0 O-C-N 121.663 -0.648 . . . . 10.0 110.672 168.335 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.41 -15.52 10.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.054 -1.029 . . . . 10.0 113.72 178.567 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -92.69 -41.8 9.96 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.291 1.037 . . . . 10.0 112.644 -179.527 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -117.94 -11.12 10.29 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.749 1.389 . . . . 10.0 114.749 -171.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.4 m -122.64 -45.94 2.15 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.404 1.482 . . . . 10.0 111.239 -169.739 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.94 -16.4 42.07 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 175.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -20.62 10.42 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 129.996 3.318 . . . . 10.0 113.699 166.464 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.9 m -142.46 -15.29 0.75 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.763 2.025 . . . . 10.0 113.443 178.413 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -133.43 62.11 1.66 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.691 2.397 . . . . 10.0 109.854 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -64.42 114.93 4.64 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.597 -1.314 . . . . 10.0 109.943 -177.293 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LEU . 24.5 t -140.9 -49.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.675 1.19 . . . . 10.0 111.676 -160.791 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.12 -10.36 1.17 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.021 1.328 . . . . 10.0 113.912 -177.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -150.15 15.56 0.82 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.486 2.714 . . . . 10.0 110.437 -179.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.379 0 C-N-CA 127.501 2.477 . . . . 10.0 115.232 -174.902 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -152.38 169.46 31.58 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.213 1.387 . . . . 10.0 110.648 171.112 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -72.29 9.62 1.13 Allowed 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.983 3.122 . . . . 10.0 115.238 -169.468 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 47.14 162.1 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 129.566 3.146 . . . . 10.0 114.39 -149.408 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.459 ' HB2' HG21 ' A' ' 20' ' ' VAL . 3.6 mm? -80.43 76.08 7.26 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.117 -0.99 . . . . 10.0 108.395 170.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -65.6 -174.01 0.18 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.929 1.292 . . . . 10.0 110.814 166.273 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.22 119.79 2.07 Favored Glycine 0 CA--C 1.537 1.426 0 O-C-N 121.24 -0.913 . . . . 10.0 112.205 166.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.45 -165.34 1.49 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 129.636 3.175 . . . . 10.0 109.137 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.309 76.6 m-85 63.4 -17.38 0.06 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.313 3.045 . . . . 10.0 118.774 173.075 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -138.69 -25.7 0.31 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 127.092 2.282 . . . . 10.0 113.432 163.539 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.4 170.28 12.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.946 1.299 . . . . 10.0 113.159 177.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.18 161.79 17.86 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.962 -1.086 . . . . 10.0 113.395 177.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.5 m -77.79 144.09 37.41 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.699 1.6 . . . . 10.0 110.539 179.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.18 0.39 65.69 Favored Glycine 0 N--CA 1.472 1.098 0 N-CA-C 115.652 1.021 . . . . 10.0 115.652 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -71.19 49.28 0.14 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 127.208 2.203 . . . . 10.0 113.81 -179.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.26 137.24 71.91 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 128.169 2.588 . . . . 10.0 113.394 -178.263 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.63 46.55 1.89 Allowed 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 123.505 2.803 . . . . 10.0 112.758 173.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.55 80.39 1.18 Allowed Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.628 1.585 . . . . 10.0 114.732 173.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -153.07 125.69 8.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.539 1.135 . . . . 10.0 111.425 173.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -79.93 87.78 5.34 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.851 1.261 . . . . 10.0 111.897 179.1 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.83 176.86 8.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.48 1.512 . . . . 10.0 112.513 166.25 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 49' ' ' THR . 0.3 OUTLIER -64.62 131.06 45.91 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.684 1.994 . . . . 10.0 109.898 158.766 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -75.13 -159.66 0.1 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.128 0.971 . . . . 10.0 111.67 172.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.38 -69.49 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.658 1.983 . . . . 10.0 113.524 -169.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.711 HD22 ' HE3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -51.23 -51.36 54.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.383 1.873 . . . . 10.0 112.747 174.43 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.711 ' HE3' HD22 ' A' ' 52' ' ' ASN . 1.8 mmpt? -72.1 -42.59 65.92 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.592 1.157 . . . . 10.0 113.107 170.584 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.6 -41.19 69.65 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.812 0.845 . . . . 10.0 112.75 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.85 -11.62 60.43 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.379 1.252 . . . . 10.0 114.379 176.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.97 9.02 55.77 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 118.182 2.033 . . . . 10.0 118.182 151.397 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.8 pp -40.64 10.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.236 2 C-N-CA 135.274 5.43 . . . . 10.0 121.893 -154.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.3 m 57.03 109.67 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 128.361 2.664 . . . . 10.0 114.646 -173.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -71.28 134.53 46.87 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.575 -1.193 . . . . 10.0 112.091 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -164.89 173.59 11.51 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 131.135 3.774 . . . . 10.0 105.595 173.12 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -57.6 -36.0 71.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 120.442 1.474 . . . . 10.0 114.036 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.97 -54.7 34.35 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.994 1.27 . . . . 10.0 111.165 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.8 p -65.77 -38.94 90.42 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.761 0.825 . . . . 10.0 111.928 -179.347 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.13 -27.61 59.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.497 1.044 . . . . 10.0 113.471 175.14 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 19.1 mtm -63.5 -53.45 51.82 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.154 1.343 . . . . 10.0 109.274 170.426 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -59.44 -45.82 90.49 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.916 0.76 . . . . 10.0 109.582 179.138 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -65.36 -48.35 73.27 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.59 -0.719 . . . . 10.0 112.762 -179.163 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.38 -29.45 67.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 120.849 1.659 . . . . 10.0 112.103 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -80.07 -22.82 41.84 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.727 1.38 . . . . 10.0 114.727 174.848 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.99 84.59 1.43 Allowed Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.218 1.407 . . . . 10.0 114.431 169.038 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.27 -49.03 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.364 2.043 . . . . 10.0 113.364 -165.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -71.66 -32.6 68.08 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.618 1.567 . . . . 10.0 111.519 -172.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -71.36 -41.84 69.22 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.603 1.161 . . . . 10.0 111.864 168.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -64.88 -48.92 72.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.18 0.9 . . . . 10.0 113.231 178.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 10.2 pt -128.75 102.39 19.79 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.688 0.795 . . . . 10.0 110.763 173.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.19 136.32 40.16 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.513 2.142 . . . . 10.0 110.752 -177.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.3 -32.39 5.09 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.581 1.562 . . . . 10.0 113.255 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m -50.44 -24.79 3.32 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 118.784 2.883 . . . . 10.0 118.784 -165.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.404 ' HE3' ' N ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 58.29 -82.69 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 116.914 -1.517 . . . . 10.0 111.602 -162.174 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.2 ttt 31.25 95.47 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.398 2.679 . . . . 10.0 113.893 -169.026 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.7 mt -71.69 45.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 C-N-CA 126.772 2.029 . . . . 10.0 112.759 -175.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -163.45 86.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.245 2.218 . . . . 10.0 108.847 178.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.23 -13.73 62.3 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.138 1.532 . . . . 10.0 115.138 -170.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.3 165.12 31.52 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.655 1.121 . . . . 10.0 111.84 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.3 tt -95.08 170.36 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.061 1.345 . . . . 10.0 111.968 -178.199 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -45.68 -45.32 14.07 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.616 2.366 . . . . 10.0 114.604 -167.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -164.55 177.87 7.79 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.945 2.498 . . . . 10.0 108.661 168.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -64.36 -27.92 69.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.332 1.605 . . . . 10.0 115.332 -171.26 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.33 -49.95 74.48 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.935 1.698 . . . . 10.0 112.025 -179.824 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -76.66 -6.61 52.78 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.195 1.798 . . . . 10.0 114.569 172.236 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER -78.76 -36.1 43.56 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.634 -1.916 . . . . 10.0 112.502 156.591 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -69.16 -42.69 75.58 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.69 -1.256 . . . . 10.0 111.002 174.661 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.503 ' CB ' ' H ' ' A' ' 2' ' ' ASP 0.256 1.0 OUTLIER -60.68 -38.19 84.13 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.909 0.484 . . . . 10.0 112.217 -179.131 . . . . . . . . 4 4 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 mp -57.09 -47.84 80.05 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.581 1.952 . . . . 10.0 113.325 166.823 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.89 -49.69 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.306 0.957 . . . . 10.0 109.458 173.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.4 -46.48 86.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.129 0.972 . . . . 10.0 112.694 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.74 -61.71 2.39 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.094 1.357 . . . . 10.0 111.696 171.452 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.1 -28.24 69.31 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.355 -0.841 . . . . 10.0 112.897 -171.866 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.15 -16.31 63.86 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 172.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -107.38 -24.21 11.92 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 167.773 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.37 60.46 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.068 1.136 . . . . 10.0 114.068 -177.718 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.1 p -86.92 -4.74 59.21 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.085 1.354 . . . . 10.0 113.668 175.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -153.45 -7.42 0.17 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 116.264 1.95 . . . . 10.0 116.264 -165.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.972 -1.966 . . . . 10.0 114.088 166.549 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 CA-C-O 118.861 -0.966 . . . . 10.0 111.333 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.29 155.61 49.9 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -150.031 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 89.5 t -55.93 -52.87 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 125.25 1.42 . . . . 10.0 110.553 177.042 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.404 ' HA ' ' CE ' ' A' ' 7' ' ' LYS . 4.2 mp0 -53.38 -53.85 45.13 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.036 1.734 . . . . 10.0 113.691 179.172 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -55.57 -36.43 66.83 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.201 0.6 . . . . 10.0 110.828 173.321 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.53 -53.11 8.91 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.414 -1.074 . . . . 10.0 110.414 -172.088 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.404 ' CE ' ' HA ' ' A' ' 4' ' ' GLU . 31.9 pttt -57.54 -46.21 84.14 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.533 1.166 . . . . 10.0 112.466 -179.766 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -67.98 -46.23 71.93 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.601 0.76 . . . . 10.0 112.586 -178.682 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.1 mm -65.7 -35.55 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 118.733 0.697 . . . . 10.0 111.252 175.134 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -61.22 -53.6 54.81 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.99 0.814 . . . . 10.0 111.293 172.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.5 t -62.92 -11.63 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.341 -0.849 . . . . 10.0 112.81 -178.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -93.38 -59.27 2.06 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.76 1.624 . . . . 10.0 110.908 174.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -95.75 -12.35 25.53 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.738 1.385 . . . . 10.0 114.738 -168.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -123.73 -43.68 2.12 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.932 1.293 . . . . 10.0 111.732 -167.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.52 -7.73 5.11 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 167.093 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -16.44 12.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.766 2.027 . . . . 10.0 113.463 163.305 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.1 m -143.34 -27.48 0.56 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.204 1.802 . . . . 10.0 114.053 179.007 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -107.49 -161.68 0.79 Allowed 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 128.916 2.887 . . . . 10.0 111.309 -178.688 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -151.3 -61.79 0.18 Allowed 'General case' 0 N--CA 1.483 1.2 0 O-C-N 119.639 -1.913 . . . . 10.0 113.765 152.714 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.444 ' HB ' ' H ' ' A' ' 32' ' ' LEU 0.277 5.1 p 51.51 -48.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 130.219 3.408 . . . . 10.0 117.786 -175.477 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.15 128.26 34.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.122 1.328 . . . . 10.0 108.02 168.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.5 pttt 45.71 30.64 0.85 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.561 1.544 . . . . 10.0 113.842 -169.033 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.885 0 C-N-CA 126.871 2.177 . . . . 10.0 112.515 179.779 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.473 0.718 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.961 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -118.28 164.53 12.84 Favored Glycine 0 CA--C 1.538 1.517 0 N-CA-C 109.373 -1.491 . . . . 10.0 109.373 157.327 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -70.42 167.25 25.85 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.879 2.386 . . . . 10.0 111.413 -178.691 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -64.89 136.9 57.37 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.027 -1.471 . . . . 10.0 107.027 158.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.444 ' H ' ' HB ' ' A' ' 20' ' ' VAL . 2.8 mm? -79.04 66.93 4.61 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.199 -0.938 . . . . 10.0 109.274 -178.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.543 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -52.36 91.29 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 129.276 3.03 . . . . 10.0 111.592 -168.928 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 65.45 -70.26 0.1 OUTLIER Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.286 1.422 . . . . 10.0 111.907 -164.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.519 HD12 ' NH1' ' A' ' 38' ' ' ARG . 0.7 OUTLIER 65.75 -176.33 0.18 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 127.125 2.17 . . . . 10.0 110.411 -168.574 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 55.83 83.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.476 1.51 . . . . 10.0 113.758 179.277 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.3 -7.05 23.01 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.023 2.725 . . . . 10.0 113.638 -177.436 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.543 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 15.8 ttp180 -86.94 -139.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.099 2.16 . . . . 10.0 114.154 -171.719 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -153.39 162.96 40.75 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.995 2.518 . . . . 10.0 111.073 -177.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 55.0 p -67.21 -59.89 3.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.739 1.216 . . . . 10.0 111.38 178.135 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.04 75.11 0.48 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 125.879 1.704 . . . . 10.0 113.835 -178.427 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -0.34 3.88 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.573 1.694 . . . . 10.0 115.573 175.002 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -52.52 134.45 44.12 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.19 1.396 . . . . 10.0 113.356 -176.689 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -82.45 -107.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.749 2.966 . . . . 10.0 111.053 179.549 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.05 48.38 3.02 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.341 -1.474 . . . . 10.0 112.993 178.508 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -151.7 163.56 38.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.375 1.559 . . . . 10.0 111.997 -177.113 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -154.84 111.37 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.664 1.585 . . . . 10.0 107.03 166.773 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -82.17 -43.22 17.99 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.457 1.503 . . . . 10.0 110.658 -176.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.2 p -156.99 -153.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 129.473 3.109 . . . . 10.0 107.773 177.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -159.86 -171.01 3.08 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.901 1.68 . . . . 10.0 108.226 157.618 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 64.55 -32.14 0.13 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.188 2.195 . . . . 10.0 113.759 -157.772 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -75.37 -42.69 53.4 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 121.975 2.17 . . . . 10.0 113.694 166.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -50.89 -51.22 53.94 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.114 -0.991 . . . . 10.0 111.383 172.294 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -66.13 -16.25 63.8 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.555 1.687 . . . . 10.0 115.555 172.03 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.46 -17.21 59.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.28 1.4 . . . . 10.0 114.224 -179.848 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.82 -44.38 2.05 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.336 -1.813 . . . . 10.0 116.6 170.781 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -31.96 3.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.736 2 C-N-CA 133.915 4.886 . . . . 10.0 122.766 -135.232 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 38.3 m 56.21 104.13 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 128.024 2.53 . . . . 10.0 114.889 -177.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -58.31 140.87 52.61 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 113.559 -1.655 . . . . 10.0 110.94 159.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -175.42 -43.29 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.297 1.439 . . . . 10.0 113.763 -165.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.253 13.6 pt-20 163.29 -62.36 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 130.0 3.32 . . . . 10.0 111.715 165.558 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -46.22 -45.21 16.82 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.39 1.476 . . . . 10.0 112.538 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.8 p -68.63 -31.43 70.58 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 125.02 1.328 . . . . 10.0 112.535 178.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -75.43 -33.25 60.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.114 1.324 . . . . 10.0 112.591 168.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.7 mtm -57.31 -53.45 58.02 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.48 1.112 . . . . 10.0 109.235 175.26 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -67.74 -41.4 83.46 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 123.917 0.761 . . . . 10.0 110.622 178.608 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.66 -53.7 25.66 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.787 0.662 . . . . 10.0 112.787 -175.867 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -60.27 -42.79 96.14 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.957 1.253 . . . . 10.0 110.934 179.041 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -72.06 -23.84 61.43 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 114.599 1.333 . . . . 10.0 114.599 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 61.65 1.59 Allowed Pre-proline 0 CA--C 1.564 1.491 0 C-N-CA 125.007 1.323 . . . . 10.0 111.088 -167.294 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.63 -62.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.359 2.706 . . . . 10.0 113.835 -162.106 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -61.58 -26.49 68.0 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.177 1.391 . . . . 10.0 113.613 -178.65 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -71.81 -51.53 22.07 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.015 0.926 . . . . 10.0 110.22 170.854 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -60.76 -47.75 84.9 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.447 0.536 . . . . 10.0 112.447 -177.58 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.85 108.09 9.05 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.319 1.047 . . . . 10.0 109.7 174.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.55 153.46 60.28 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 122.03 1.82 . . . . 10.0 110.616 172.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.74 46.43 4.56 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-O 118.956 -0.913 . . . . 10.0 111.922 -170.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -138.44 -39.03 0.53 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 116.051 1.871 . . . . 10.0 116.051 -165.911 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt 60.27 -65.74 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 -171.279 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.7 ttt 20.46 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 130.059 3.344 . . . . 10.0 113.063 -171.193 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 81' ' ' ILE . 4.0 mp -69.5 74.25 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 126.423 1.889 . . . . 10.0 110.054 -175.432 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -163.51 -40.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.8 1.64 . . . . 10.0 112.605 178.648 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.57 82.6 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.025 2.53 . . . . 10.0 115.253 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.63 -161.37 16.88 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.942 1.258 . . . . 10.0 111.445 -169.217 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.6 tt -143.33 30.37 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.637 1.175 . . . . 10.0 110.435 170.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttt 69.35 0.59 2.94 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.459 2.304 . . . . 10.0 113.993 -175.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -162.61 173.49 13.86 Favored 'General case' 0 CA--C 1.542 0.649 1 C-N-CA 132.551 4.341 . . . . 10.0 106.979 -176.771 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -77.47 -52.06 9.72 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 155.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 m -43.65 -50.62 7.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.377 1.871 . . . . 10.0 113.054 -155.259 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -65.52 -24.47 67.13 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.652 0.781 . . . . 10.0 112.269 -173.347 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.474 HH21 HD12 ' A' ' 95' ' ' ILE 0.373 0.0 OUTLIER -76.18 -13.0 60.19 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.328 0.967 . . . . 10.0 113.441 172.498 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -67.31 -52.64 37.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.857 0.863 . . . . 10.0 109.979 161.179 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -57.61 -44.28 85.34 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.52 1.528 . . . . 10.0 112.828 177.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.88 90.13 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.991 0.737 . . . . 10.0 112.991 174.303 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.474 HD12 HH21 ' A' ' 91' ' ' ARG . 14.3 mt -62.18 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 119.035 -0.507 . . . . 10.0 110.538 173.583 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.31 75.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.43 0.692 . . . . 10.0 111.916 175.307 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.2 -57.51 12.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.813 1.645 . . . . 10.0 112.946 173.062 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -66.72 -29.12 69.03 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.657 1.117 . . . . 10.0 113.22 -175.019 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -59.27 -26.95 65.37 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.841 0.856 . . . . 10.0 112.919 168.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -85.56 -53.23 5.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 117.821 -1.085 . . . . 10.0 112.009 165.644 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.37 -15.74 39.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.967 1.84 . . . . 10.0 115.967 -171.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.3 t -68.46 -2.78 9.42 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.133 1.161 . . . . 10.0 114.133 165.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -151.2 -23.6 0.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.225 1.81 . . . . 10.0 114.071 -176.218 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.7 2.0 . . . . 10.0 110.921 179.639 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 CA-C-O 118.735 -1.036 . . . . 10.0 110.708 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -133.76 161.38 34.86 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.256 1.206 . . . . 10.0 114.256 -152.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.7 m -68.35 -41.49 83.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 122.709 0.403 . . . . 10.0 111.977 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 mp0 -60.76 -49.26 78.22 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.843 1.257 . . . . 10.0 110.26 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.442 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 8.8 mmpt? -62.71 -14.77 47.99 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.687 1.195 . . . . 10.0 113.095 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -104.79 -45.34 1.41 Allowed Glycine 0 C--N 1.339 0.704 0 CA-C-N 119.703 1.138 . . . . 10.0 112.46 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -34.69 72.3 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.709 1.754 . . . . 10.0 112.443 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -62.19 -28.67 69.83 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.832 1.253 . . . . 10.0 114.259 177.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -98.42 -32.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.139 0.976 . . . . 10.0 110.684 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.478 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 t80 -57.82 -54.32 48.25 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 121.823 -0.548 . . . . 10.0 110.935 169.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.5 t -66.01 -11.62 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -90.25 -56.04 3.37 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.721 1.208 . . . . 10.0 111.325 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -125.59 7.76 7.6 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 116.238 1.94 . . . . 10.0 116.238 -168.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 33.7 m -110.76 -49.01 3.07 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.295 1.038 . . . . 10.0 110.648 166.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.53 53.07 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.919 1.081 . . . . 10.0 113.919 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -13.77 39.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.827 2.451 . . . . 10.0 113.564 169.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 88.6 m -141.15 -33.64 0.52 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.229 1.812 . . . . 10.0 112.237 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -120.19 66.6 0.83 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 128.954 2.902 . . . . 10.0 109.922 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -68.19 127.49 33.11 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.356 -1.465 . . . . 10.0 108.178 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.42 -66.39 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 124.632 1.173 . . . . 10.0 110.595 -176.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.53 -31.32 65.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.184 0.902 . . . . 10.0 112.698 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.17 -6.23 59.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.55 1.14 . . . . 10.0 113.785 178.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 120.33 126.5 3.39 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 126.596 2.046 . . . . 10.0 110.871 -163.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -46.15 127.54 9.56 Favored Glycine 0 CA--C 1.538 1.497 0 C-N-CA 125.97 1.747 . . . . 10.0 114.835 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.43 97.76 1.0 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.213 1.805 . . . . 10.0 111.432 169.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.574 ' HB3' ' H ' ' A' ' 31' ' ' ASN . 16.6 p80 -72.29 57.43 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.759 1.623 . . . . 10.0 112.492 170.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.9 pttt -83.14 -17.58 42.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.761 1.393 . . . . 10.0 114.761 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.4 m -154.3 -10.42 0.14 Allowed 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.056 -1.027 . . . . 10.0 113.398 170.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.66 167.35 24.83 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 157.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.02 127.9 16.8 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.854 2.369 . . . . 10.0 110.805 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.574 ' H ' ' HB3' ' A' ' 26' ' ' HIS . 0.3 OUTLIER -63.99 127.61 32.19 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.224 -0.923 . . . . 10.0 110.45 -178.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.7 81.5 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.858 1.263 . . . . 10.0 111.862 -170.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.68 73.14 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.111 2.164 . . . . 10.0 109.962 163.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.78 -63.08 0.32 Allowed Glycine 0 CA--C 1.535 1.312 0 C-N-CA 127.718 2.58 . . . . 10.0 114.065 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.473 ' CD2' HMA3 ' A' ' 105' ' ' HEC . 1.0 OUTLIER 68.29 -48.6 0.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.449 2.7 . . . . 10.0 116.022 -178.164 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.715 ' HB2' HG21 ' A' ' 102' ' ' THR . 41.8 m-85 -63.67 113.44 3.36 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.595 1.089 . . . . 10.0 111.095 -174.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.48 0.0 82.37 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.954 1.264 . . . . 10.0 113.947 -175.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.8 mtp85 -86.89 -127.93 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.901 1.281 . . . . 10.0 110.802 172.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -154.35 173.41 16.23 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.188 1.795 . . . . 10.0 110.99 -172.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 t -95.8 -48.16 5.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.967 0.907 . . . . 10.0 113.344 -174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.05 61.66 2.99 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.528 1.537 . . . . 10.0 111.609 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.3 tp60 -130.15 -18.96 3.23 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.088 1.755 . . . . 10.0 113.347 -161.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.32 151.74 86.5 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 124.464 1.105 . . . . 10.0 112.572 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -76.01 -160.19 0.11 Allowed 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 124.277 3.318 . . . . 10.0 110.839 167.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.23 86.96 0.01 OUTLIER Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.715 2.103 . . . . 10.0 115.327 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -144.05 -179.43 6.49 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.329 2.252 . . . . 10.0 109.559 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.6 m -156.86 142.9 17.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 119.741 -1.849 . . . . 10.0 109.774 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.55 -85.72 0.06 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.886 0.874 . . . . 10.0 112.806 -163.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 t -144.93 173.85 11.52 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.639 2.776 . . . . 10.0 108.751 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.05 -37.33 58.42 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.953 -1.092 . . . . 10.0 112.322 155.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.1 -61.82 1.99 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.022 1.329 . . . . 10.0 112.776 -160.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -51.71 -61.82 2.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.963 0.905 . . . . 10.0 111.906 -171.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -56.08 26.79 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.418 1.087 . . . . 10.0 111.847 -176.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -44.2 82.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.176 -0.916 . . . . 10.0 111.737 -171.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.59 -45.25 38.7 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.171 -0.919 . . . . 10.0 111.708 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 55.37 -179.24 0.33 Allowed Glycine 0 CA--C 1.54 1.621 0 N-CA-C 116.696 1.438 . . . . 10.0 116.696 -176.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.66 -6.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 128.328 2.651 . . . . 10.0 113.701 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.0 m 55.84 115.95 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.846 2.059 . . . . 10.0 113.038 -159.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -73.09 126.3 29.67 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.295 -0.878 . . . . 10.0 111.658 175.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -165.34 176.03 8.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.272 2.229 . . . . 10.0 110.184 -174.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.32 -30.06 64.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.248 1.419 . . . . 10.0 114.33 -176.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -71.96 -71.65 0.27 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.853 0.861 . . . . 10.0 110.746 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.5 p -59.61 -38.15 80.49 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 125.88 1.672 . . . . 10.0 112.844 -165.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.28 -29.44 60.11 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.289 0.949 . . . . 10.0 113.134 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 ttm -69.6 -48.75 59.07 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 171.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -57.29 -45.0 84.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.275 1.43 . . . . 10.0 110.546 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.415 ' HE1' HG21 ' A' ' 78' ' ' THR . 73.1 t80 -61.48 -60.04 4.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.619 1.568 . . . . 10.0 112.945 172.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -56.63 -32.23 65.12 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.783 1.629 . . . . 10.0 114.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.21 -24.61 63.13 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.909 1.448 . . . . 10.0 114.909 174.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -163.3 91.71 1.17 Allowed Pre-proline 0 CA--C 1.552 1.035 0 CA-C-N 119.759 1.163 . . . . 10.0 112.602 162.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.98 -37.99 2.48 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.406 2.071 . . . . 10.0 112.544 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -59.06 -43.12 91.69 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.878 1.671 . . . . 10.0 112.444 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -75.0 -41.06 60.24 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 118.982 -0.532 . . . . 10.0 111.434 175.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -69.04 -36.72 78.03 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.821 1.415 . . . . 10.0 114.821 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -131.18 127.82 21.99 Favored Pre-proline 0 N--CA 1.475 0.788 0 CA-C-N 119.169 0.895 . . . . 10.0 111.035 172.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.15 93.8 0.73 Allowed 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.912 3.075 . . . . 10.0 113.315 -153.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 110.97 0.0 28.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.574 1.083 . . . . 10.0 114.299 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.497 HG23 ' CGD' ' A' ' 105' ' ' HEC . 12.5 m -60.15 106.58 0.53 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.68 1.24 . . . . 10.0 111.206 172.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -64.36 -56.67 12.8 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.211 -0.9 . . . . 10.0 112.157 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.0 ttt 25.31 84.2 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.814 2.445 . . . . 10.0 114.115 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 30.8 mt -73.57 77.33 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.937 1.295 . . . . 10.0 110.829 -172.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -163.34 -45.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.15 1.78 . . . . 10.0 111.62 170.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.58 0.96 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 120.743 3.608 . . . . 10.0 120.743 172.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.72 170.71 40.65 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 125.516 1.531 . . . . 10.0 111.176 169.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -143.18 63.12 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 118.809 1.305 . . . . 10.0 112.861 -164.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 62.29 -56.87 0.14 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 128.22 2.608 . . . . 10.0 116.096 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -163.47 156.25 18.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.6 2.36 . . . . 10.0 109.096 -169.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -7.7 11.79 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 10.0 115.301 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -54.1 8.8 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.446 1.499 . . . . 10.0 110.751 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -54.28 -35.3 62.42 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.306 1.042 . . . . 10.0 110.95 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -56.8 -65.19 0.66 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.583 1.953 . . . . 10.0 112.107 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -31.56 72.47 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.997 0.74 . . . . 10.0 112.997 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -57.55 -47.42 82.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.692 0.797 . . . . 10.0 110.61 170.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.82 -46.43 84.7 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 175.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.1 mm -56.48 -52.53 51.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.82 60.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 117.64 -1.171 . . . . 10.0 113.669 -174.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.4 -64.87 0.76 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.374 1.869 . . . . 10.0 110.805 162.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.6 mt -60.17 -30.28 69.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.278 0.631 . . . . 10.0 112.684 -174.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -59.3 -21.93 60.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.872 1.064 . . . . 10.0 113.872 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -79.27 -45.19 20.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.694 -1.146 . . . . 10.0 110.809 168.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.19 1.28 0.19 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.304 1.594 . . . . 10.0 115.304 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.715 HG21 ' HB2' ' A' ' 36' ' ' PHE . 9.6 p -110.37 11.84 23.21 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.859 1.663 . . . . 10.0 114.348 168.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -153.57 -34.59 0.11 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.534 1.061 . . . . 10.0 113.815 175.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 . . . . . 0 C--O 1.259 1.563 0 C-N-CA 125.161 1.385 . . . . 10.0 110.9 149.669 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.497 ' CGD' HG23 ' A' ' 78' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.896 0 CA-C-O 118.416 -1.213 . . . . 10.0 111.007 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -109.21 145.51 35.74 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.905 0.852 . . . . 10.0 112.467 -167.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.12 -41.43 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 118.413 -0.803 . . . . 10.0 112.005 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -51.79 -57.03 10.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.911 1.284 . . . . 10.0 112.611 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -57.06 -25.5 58.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.006 1.323 . . . . 10.0 111.722 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -86.94 -50.37 3.73 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.406 1.479 . . . . 10.0 111.841 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.5 pttp -63.13 -43.21 99.01 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.76 1.28 . . . . 10.0 111.57 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -40.83 97.7 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.054 -0.974 . . . . 10.0 111.728 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.85 -25.29 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 119.384 0.993 . . . . 10.0 112.774 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -55.96 -50.75 69.94 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.249 -0.907 . . . . 10.0 109.681 163.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.04 29.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 N-CA-C 113.415 0.894 . . . . 10.0 113.415 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -36.57 5.36 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 119.265 -2.147 . . . . 10.0 112.272 164.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.99 -55.59 1.37 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.631 0.772 . . . . 10.0 112.921 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.4 m -52.15 -49.49 63.66 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 125.256 1.422 . . . . 10.0 112.802 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.7 -22.87 62.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.925 1.083 . . . . 10.0 113.925 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -16.16 51.29 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.92 0.888 . . . . 10.0 112.356 173.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 82.1 m -141.34 0.51 1.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.864 1.266 . . . . 10.0 114.228 -174.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 97.1 m-70 -150.47 12.17 0.71 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.593 1.331 . . . . 10.0 114.593 -172.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 t -42.76 104.9 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.7 1.741 . . . . 10.0 115.7 -165.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.8 p -142.29 -8.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 127.339 2.256 . . . . 10.0 112.559 -171.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.73 -18.82 13.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.124 1.369 . . . . 10.0 112.033 165.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -152.76 145.98 24.72 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.395 1.478 . . . . 10.0 110.981 155.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 -59.1 2.27 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.354 1.454 . . . . 10.0 115.559 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.87 120.69 1.79 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 124.527 1.06 . . . . 10.0 112.231 -169.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.22 150.3 18.21 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 128.244 2.618 . . . . 10.0 108.841 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -81.57 -96.81 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.571 1.148 . . . . 10.0 111.548 -175.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 mttm 56.33 106.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 128.506 2.723 . . . . 10.0 112.73 -169.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.2 m 57.85 -31.42 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.612 2.365 . . . . 10.0 116.676 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.57 168.86 14.98 Favored Glycine 0 CA--C 1.543 1.807 0 CA-C-N 120.582 1.537 . . . . 10.0 112.918 171.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 20.9 Cg_endo -71.55 -8.09 22.54 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 124.691 3.594 . . . . 10.0 118.61 -167.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.57 142.16 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.741 1.616 . . . . 10.0 113.87 -154.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -85.51 70.39 10.76 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.052 -1.03 . . . . 10.0 110.157 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.27 114.53 1.83 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.316 1.446 . . . . 10.0 110.17 165.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 9.14 76.36 0.01 OUTLIER Glycine 0 N--CA 1.476 1.308 0 C-N-CA 129.044 3.212 . . . . 10.0 115.9 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD21 HMA3 ' A' ' 105' ' ' HEC . 0.5 OUTLIER -72.06 -30.6 65.3 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 116.189 1.922 . . . . 10.0 116.189 -156.337 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -85.87 93.67 8.97 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.965 0.802 . . . . 10.0 111.607 -159.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.08 -13.91 6.31 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 127.051 2.262 . . . . 10.0 114.282 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -85.81 157.98 20.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.733 1.266 . . . . 10.0 113.416 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -77.01 169.76 17.75 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.659 1.184 . . . . 10.0 112.023 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.2 t -50.91 155.54 1.17 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.065 2.146 . . . . 10.0 115.927 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 59.11 31.06 68.11 Favored Glycine 0 CA--C 1.539 1.546 0 N-CA-C 118.458 2.143 . . . . 10.0 118.458 155.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -83.59 7.0 18.62 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 120.241 2.021 . . . . 10.0 115.363 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 133.91 93.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.623 1.102 . . . . 10.0 112.72 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.12 87.38 0.73 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.646 2.23 . . . . 10.0 113.041 -172.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.13 -1.7 88.5 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.947 1.736 . . . . 10.0 115.823 167.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -66.39 137.08 56.62 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.754 1.277 . . . . 10.0 112.067 176.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 m -72.61 83.08 1.13 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.716 1.607 . . . . 10.0 112.652 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.28 175.33 9.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.639 1.176 . . . . 10.0 112.917 168.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.1 p -76.68 -175.36 3.36 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.695 1.598 . . . . 10.0 113.572 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -66.79 177.09 1.75 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.208 1.403 . . . . 10.0 113.23 152.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.67 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 129.352 3.061 . . . . 10.0 116.029 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.573 HD22 ' CGD' ' A' ' 105' ' ' HEC . 8.6 t30 -47.61 -59.93 2.91 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.891 1.678 . . . . 10.0 112.286 -170.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -27.0 68.97 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.545 -0.722 . . . . 10.0 112.482 -176.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -26.8 63.86 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 117.209 2.3 . . . . 10.0 117.209 171.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -163.29 -1.31 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 116.648 2.092 . . . . 10.0 116.648 -155.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -67.85 163.34 47.47 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 125.63 1.586 . . . . 10.0 114.107 -177.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -66.31 173.89 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.89 2.476 . . . . 10.0 114.206 -176.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 m -69.57 124.33 23.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.024 0.93 . . . . 10.0 110.232 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -75.38 124.64 27.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.578 0.751 . . . . 10.0 111.716 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.8 pttt -171.3 -176.73 1.95 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.562 2.345 . . . . 10.0 109.5 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.33 -55.07 5.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.901 0.88 . . . . 10.0 112.299 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.21 12.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.948 2.499 . . . . 10.0 115.783 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 63.5 p -157.67 -34.8 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.246 1.018 . . . . 10.0 111.356 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -33.27 60.69 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.807 1.185 . . . . 10.0 112.761 169.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 70.3 mtm -66.28 -48.15 71.35 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.979 1.263 . . . . 10.0 110.521 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -63.89 -37.79 88.71 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 122.652 0.381 . . . . 10.0 110.397 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -65.01 -60.63 2.83 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-O 119.035 -0.507 . . . . 10.0 111.927 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.54 -29.92 70.31 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 120.196 1.362 . . . . 10.0 112.444 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -69.08 -31.24 69.84 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.551 1.315 . . . . 10.0 114.551 170.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.84 76.79 1.67 Allowed Pre-proline 0 CA--C 1.553 1.078 0 CA-C-N 120.035 1.289 . . . . 10.0 113.163 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.01 -44.23 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.928 1.752 . . . . 10.0 111.942 -159.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -68.03 -30.65 69.93 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 126.427 1.891 . . . . 10.0 112.7 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -76.26 -40.24 52.36 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.737 1.215 . . . . 10.0 112.352 168.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -63.97 -45.88 87.1 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.748 0.704 . . . . 10.0 112.45 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.8 pt -142.99 129.39 10.52 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.796 1.638 . . . . 10.0 110.414 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.62 179.42 4.7 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.806 2.337 . . . . 10.0 112.656 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.2 -33.87 1.1 Allowed Glycine 0 CA--C 1.529 0.943 0 C-N-CA 126.216 1.865 . . . . 10.0 114.156 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 90.3 m -60.56 83.26 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.997 1.719 . . . . 10.0 113.957 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -68.22 31.96 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.477 2.711 . . . . 10.0 114.123 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.7 ttt -64.39 108.78 1.72 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.058 1.743 . . . . 10.0 111.219 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 mt -76.5 67.33 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.856 1.262 . . . . 10.0 110.481 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -163.43 -35.9 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.693 1.368 . . . . 10.0 114.693 172.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.22 -3.96 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 121.154 3.761 . . . . 10.0 121.154 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.83 -147.72 5.08 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-N 120.868 1.667 . . . . 10.0 112.148 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tt -144.48 171.86 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.937 0.895 . . . . 10.0 108.89 158.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -75.01 -7.31 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.618 1.34 . . . . 10.0 114.618 -160.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.59 -67.37 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.882 1.273 . . . . 10.0 110.666 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.38 -53.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 127.577 2.351 . . . . 10.0 112.634 162.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.7 m -50.92 -33.62 25.07 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.357 1.863 . . . . 10.0 112.118 -168.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -45.15 -50.09 11.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.254 1.422 . . . . 10.0 112.202 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.353 0.0 OUTLIER -77.76 -10.84 59.75 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.112 1.523 . . . . 10.0 115.112 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -75.02 -40.72 60.36 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.163 0.892 . . . . 10.0 110.488 162.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.22 -40.28 78.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.417 1.087 . . . . 10.0 112.092 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.534 HD21 HMB1 ' A' ' 105' ' ' HEC . 15.9 tp -57.84 -46.23 85.08 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.579 1.552 . . . . 10.0 113.122 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 mm -59.07 -46.42 91.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 C-N-CA 124.176 0.99 . . . . 10.0 109.786 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -43.36 98.75 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.146 0.43 . . . . 10.0 111.931 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.6 -56.64 19.6 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.824 0.85 . . . . 10.0 111.974 170.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.15 -26.55 68.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.778 1.172 . . . . 10.0 112.955 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.01 -12.2 7.54 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.402 1.481 . . . . 10.0 113.382 167.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -131.62 36.04 3.77 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.206 3.002 . . . . 10.0 111.979 166.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.72 30.69 4.34 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.4 1.48 . . . . 10.0 110.052 154.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -142.36 7.73 1.76 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.895 2.078 . . . . 10.0 115.112 -174.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -153.05 -73.24 0.14 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.454 2.302 . . . . 10.0 108.242 177.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.258 1.529 0 CA-C-O 117.133 -1.413 . . . . 10.0 109.083 124.222 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.573 ' CGD' HD22 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.96 0 CA-C-O 119.112 -0.826 . . . . 10.0 111.407 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.401 ' HB3' ' H ' ' A' ' 4' ' ' GLU . 57.8 m-20 -93.99 -173.16 3.04 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.399 1.88 . . . . 10.0 110.853 176.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.0 t -78.78 -32.9 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 120.312 -1.492 . . . . 10.0 111.166 143.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' H ' ' HB3' ' A' ' 2' ' ' ASP . 0.6 OUTLIER -68.15 -36.08 79.1 Favored 'General case' 0 CA--C 1.514 -0.425 0 C-N-CA 128.063 2.545 . . . . 10.0 114.224 -159.653 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -73.36 -25.47 60.61 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.44 -54.5 5.51 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 126.167 1.842 . . . . 10.0 110.289 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -23.39 67.4 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.485 1.291 . . . . 10.0 114.485 178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -76.49 -53.49 8.03 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 120.143 1.338 . . . . 10.0 113.414 164.283 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.32 -31.33 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.438 1.017 . . . . 10.0 112.555 -170.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -56.56 -51.31 69.06 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.175 0.443 . . . . 10.0 109.999 172.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.2 -9.1 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 112.868 0.692 . . . . 10.0 112.868 -177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -96.11 -47.68 5.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.374 1.47 . . . . 10.0 111.562 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -119.62 -8.53 9.94 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.428 1.64 . . . . 10.0 115.428 -170.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 34.5 m -113.92 -45.16 3.1 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.813 1.245 . . . . 10.0 111.325 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.21 -25.04 61.13 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 176.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.05 -14.39 0.41 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.415 2.686 . . . . 10.0 114.096 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -141.23 -34.7 0.48 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.609 1.564 . . . . 10.0 112.053 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -103.58 -9.68 19.05 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.949 1.463 . . . . 10.0 114.949 -173.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' H ' ' A' ' 20' ' ' VAL 0.359 6.8 t 38.58 -88.93 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.305 2.642 . . . . 10.0 115.694 -166.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 19' ' ' THR 0.3 8.7 p 37.48 48.51 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 128.965 2.906 . . . . 10.0 115.986 174.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.44 -41.11 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.274 1.03 . . . . 10.0 112.784 170.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -154.14 -40.99 0.09 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 130.431 3.492 . . . . 10.0 110.786 -173.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.45 136.04 13.24 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 127.064 2.269 . . . . 10.0 112.302 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.19 121.01 7.06 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.682 1.611 . . . . 10.0 112.173 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.416 ' HD3' ' H ' ' A' ' 26' ' ' HIS . 5.0 tmtt? -164.6 171.25 14.71 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.266 2.626 . . . . 10.0 108.068 -178.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.416 ' H ' ' HD3' ' A' ' 25' ' ' LYS . 2.2 p80 -154.47 115.46 4.02 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.407 1.483 . . . . 10.0 108.826 -174.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.46 124.3 13.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.089 0.556 . . . . 10.0 110.047 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.435 ' O ' HMD3 ' A' ' 105' ' ' HEC . 11.9 m 56.26 -19.77 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.763 2.025 . . . . 10.0 115.66 -166.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -133.72 163.82 24.42 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.564 2.031 . . . . 10.0 111.754 162.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.72 161.56 21.6 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.261 2.641 . . . . 10.0 112.075 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.546 HD21 ' CD2' ' A' ' 33' ' ' HIS . 8.9 p-10 -65.29 11.25 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 130.267 3.427 . . . . 10.0 115.944 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt 50.52 -33.25 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.952 1 C-N-CA 132.075 4.15 . . . . 10.0 118.181 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.546 ' CD2' HD21 ' A' ' 31' ' ' ASN 0.276 0.0 OUTLIER 34.5 72.58 0.09 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.631 3.172 . . . . 10.0 114.227 178.789 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.92 -34.49 0.74 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 126.288 1.899 . . . . 10.0 114.667 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tp 60.51 -68.08 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.814 3.246 . . . . 10.0 116.387 170.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-30 -65.67 114.51 5.03 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.645 1.578 . . . . 10.0 110.82 -171.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.68 1.83 88.94 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 118.654 -1.081 . . . . 10.0 114.484 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.573 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.6 OUTLIER -78.81 -96.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.887 1.343 . . . . 10.0 108.469 169.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -156.64 175.18 14.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.752 2.421 . . . . 10.0 109.781 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.7 m -109.09 95.37 5.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.871 -1.9 . . . . 10.0 105.871 153.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.27 -66.3 0.09 OUTLIER Glycine 0 CA--C 1.528 0.858 0 CA-C-O 122.022 0.79 . . . . 10.0 113.069 -163.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -64.77 133.91 53.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.679 1.992 . . . . 10.0 113.514 -172.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.66 150.76 10.48 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 128.47 2.708 . . . . 10.0 107.317 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.57 66.27 8.55 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.734 2.956 . . . . 10.0 111.817 -176.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.86 71.59 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.295 0.95 . . . . 10.0 115.219 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.11 119.59 10.46 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.08 1.352 . . . . 10.0 111.204 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.0 m -70.92 82.98 0.66 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.291 1.837 . . . . 10.0 113.174 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -86.17 -173.25 4.47 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.795 1.638 . . . . 10.0 113.896 170.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.3 t -62.57 172.49 1.57 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 126.188 1.795 . . . . 10.0 111.581 168.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -75.47 -80.44 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 120.417 -1.427 . . . . 10.0 111.511 154.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 69.42 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 131.365 3.866 . . . . 10.0 116.498 -165.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -161.68 -70.89 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.363 2.265 . . . . 10.0 107.601 169.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.544 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -55.16 -37.44 66.99 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.11 2.564 . . . . 10.0 111.197 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.74 -37.6 84.82 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.54 1.136 . . . . 10.0 113.192 176.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -76.91 -50.09 14.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.076 0.853 . . . . 10.0 112.011 170.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.34 82.16 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.896 1.236 . . . . 10.0 113.394 -175.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.5 pp -66.23 -16.95 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.067 -1.255 . . . . 10.0 113.618 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.507 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 24.3 m 55.77 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 129.378 3.071 . . . . 10.0 113.393 -169.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.501 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 51.2 m95 -77.18 146.78 36.84 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 120.887 -1.133 . . . . 10.0 111.421 168.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 58' ' ' THR . 7.2 ptpt -163.64 -51.46 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.351 1.46 . . . . 10.0 110.939 -170.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 171.87 -55.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 130.338 3.455 . . . . 10.0 109.44 164.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -44.72 -54.9 5.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.148 2.179 . . . . 10.0 112.48 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 66.9 p -65.52 -28.25 69.04 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 125.213 1.405 . . . . 10.0 113.209 -173.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.507 HD22 HH12 ' A' ' 91' ' ' ARG . 0.3 OUTLIER -75.21 -28.5 59.99 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.375 1.07 . . . . 10.0 112.337 173.423 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.4 mtm -69.88 -47.5 62.37 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-O 118.738 -0.649 . . . . 10.0 110.793 172.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -61.83 -43.2 99.33 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.153 0.502 . . . . 10.0 110.438 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.482 ' HE1' HG21 ' A' ' 78' ' ' THR . 43.0 t80 -57.97 -67.41 0.34 Allowed 'General case' 0 C--O 1.221 -0.441 0 CA-C-O 117.553 -1.213 . . . . 10.0 111.924 176.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.483 ' HB2' HH11 ' A' ' 91' ' ' ARG . 5.4 mt -65.87 -19.55 65.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 121.439 1.927 . . . . 10.0 114.816 -173.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -73.75 -24.7 59.91 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.813 1.188 . . . . 10.0 113.881 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.78 64.84 1.55 Allowed Pre-proline 0 CA--C 1.559 1.311 0 CA-C-N 120.124 1.329 . . . . 10.0 112.999 -177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -72.32 -46.58 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.183 1.922 . . . . 10.0 113.014 -159.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -26.47 68.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.552 1.141 . . . . 10.0 112.697 176.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -76.16 -48.07 21.87 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.728 0.811 . . . . 10.0 111.291 169.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.65 -38.1 88.38 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.561 0.948 . . . . 10.0 113.561 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.1 pt -142.81 105.58 5.33 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.819 1.248 . . . . 10.0 109.644 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -67.16 -24.58 44.29 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.484 2.789 . . . . 10.0 115.321 -155.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.33 -9.53 81.7 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.586 -1.119 . . . . 10.0 114.385 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.482 HG21 ' HE1' ' A' ' 67' ' ' TYR . 86.1 m -76.88 75.75 3.48 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.916 1.858 . . . . 10.0 112.442 -172.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -68.97 27.11 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.714 2.006 . . . . 10.0 114.609 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.43 ' HA ' HMD2 ' A' ' 105' ' ' HEC . 48.8 ttp -50.67 117.68 2.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.31 2.244 . . . . 10.0 111.83 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.0 mt -76.48 68.3 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 125.511 1.524 . . . . 10.0 109.638 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -163.85 -32.28 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.466 1.506 . . . . 10.0 113.533 174.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.7 -24.06 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 120.145 3.387 . . . . 10.0 120.145 -173.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 173.02 167.2 32.6 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 122.131 2.242 . . . . 10.0 113.844 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 tt -93.32 160.71 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.868 0.867 . . . . 10.0 111.909 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.07 -31.49 65.26 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 116.024 1.861 . . . . 10.0 116.024 -167.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -164.34 148.61 9.68 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.724 1.61 . . . . 10.0 109.766 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -20.62 65.28 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.326 1.232 . . . . 10.0 114.326 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.0 m -59.26 -44.25 92.42 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.08 -1.013 . . . . 10.0 111.254 171.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.03 -35.83 82.43 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.297 1.439 . . . . 10.0 111.045 177.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.507 HH12 HD22 ' A' ' 64' ' ' LEU . 8.1 tpm_? -60.08 -47.94 83.78 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.316 1.446 . . . . 10.0 111.239 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -59.31 -51.32 70.43 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.626 0.77 . . . . 10.0 111.485 170.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -43.71 81.39 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.826 1.65 . . . . 10.0 112.683 -174.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.6 -37.88 73.97 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.35 -48.75 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 118.639 0.654 . . . . 10.0 109.441 173.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.04 -49.78 76.58 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.369 0.668 . . . . 10.0 112.038 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.05 -59.16 5.14 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.091 0.956 . . . . 10.0 111.91 172.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.45 -35.62 79.86 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.406 1.003 . . . . 10.0 112.201 -176.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.74 -15.93 63.3 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.462 1.028 . . . . 10.0 112.976 177.129 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -109.84 20.56 17.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.059 1.343 . . . . 10.0 114.248 165.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.56 -1.18 14.15 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.596 1.558 . . . . 10.0 112.561 164.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.47 -4.36 57.33 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.798 -1.189 . . . . 10.0 113.053 173.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -154.9 3.34 0.21 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.104 1.362 . . . . 10.0 113.973 -159.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 127.755 2.422 . . . . 10.0 107.809 -173.232 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.501 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 110.623 -0.991 . . . . 10.0 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -136.76 135.94 38.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.537 1.535 . . . . 10.0 109.198 -161.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.9 t -54.33 -49.95 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.94 0.896 . . . . 10.0 111.08 -172.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.96 -56.31 19.0 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.674 1.59 . . . . 10.0 112.976 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 32.5 mtmm -61.01 -24.87 66.49 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 112.875 0.695 . . . . 10.0 112.875 175.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.48 -50.58 6.53 Favored Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.042 -1.223 . . . . 10.0 110.042 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -63.32 -43.16 98.59 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 118.911 1.355 . . . . 10.0 113.274 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HE3' ' O ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -62.36 -39.21 92.39 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.134 0.879 . . . . 10.0 112.75 179.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -79.29 -36.07 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.792 0.724 . . . . 10.0 111.719 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -56.21 -48.85 75.63 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.997 0.919 . . . . 10.0 110.683 171.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.61 -15.58 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 113.609 0.966 . . . . 10.0 113.609 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -96.08 -33.72 11.99 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 123.946 0.898 . . . . 10.0 113.42 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -135.9 1.84 2.8 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 116.109 1.892 . . . . 10.0 116.109 -172.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -122.12 -49.2 2.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.013 1.725 . . . . 10.0 110.851 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.72 66.71 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.545 0.943 . . . . 10.0 113.545 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -46.07 -47.92 17.05 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.911 1.684 . . . . 10.0 112.057 171.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 98.5 m -89.22 -44.39 10.31 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 10.0 113.408 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 88.9 m-70 -105.96 -10.02 16.8 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.607 2.077 . . . . 10.0 116.607 -162.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.308 11.1 t 37.42 -82.17 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 127.699 2.4 . . . . 10.0 116.732 -164.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.267 7.5 p 46.25 -51.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 131.35 3.86 . . . . 10.0 116.055 -161.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -20.11 0.1 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 131.487 3.915 . . . . 10.0 117.642 -168.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.4 pttm -152.49 22.57 0.62 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.844 1.658 . . . . 10.0 111.546 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -163.09 54.58 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 121.891 0.717 . . . . 10.0 111.862 -165.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.2 -123.67 5.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.467 1.984 . . . . 10.0 110.6 -176.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -160.38 165.09 31.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.421 1.088 . . . . 10.0 112.529 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -78.96 129.63 34.69 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.118 2.567 . . . . 10.0 112.011 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.72 108.92 5.01 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.422 1.089 . . . . 10.0 108.944 173.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 m 56.62 -29.03 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 127.274 2.23 . . . . 10.0 115.46 -163.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.03 136.3 12.92 Favored Glycine 0 CA--C 1.542 1.769 0 CA-C-N 120.748 1.613 . . . . 10.0 111.65 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 9.6 Cg_endo -59.66 1.57 0.39 Allowed 'Trans proline' 0 C--N 1.353 0.787 1 C-N-CA 127.2 5.266 . . . . 10.0 118.411 -173.218 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER 63.11 143.02 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.916 2.486 . . . . 10.0 114.12 -161.119 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.29 65.41 9.19 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.287 1.042 . . . . 10.0 110.913 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.81 163.58 1.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.048 1.339 . . . . 10.0 111.446 158.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.8 85.87 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.933 1.73 . . . . 10.0 116.267 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.18 -168.14 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.222 2.609 . . . . 10.0 113.215 169.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 55.02 35.28 24.33 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.819 2.448 . . . . 10.0 114.622 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 166.84 -19.64 0.09 OUTLIER Glycine 0 CA--C 1.531 1.075 0 N-CA-C 115.271 0.869 . . . . 10.0 115.271 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.422 ' HE ' ' HB2' ' A' ' 42' ' ' GLN . 4.2 ptm180 -74.58 -145.23 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.909 1.284 . . . . 10.0 110.994 164.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -151.85 -179.74 7.73 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.636 1.974 . . . . 10.0 109.072 171.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.2 p -59.8 158.32 10.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.448 1.118 . . . . 10.0 112.971 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.0 -8.24 78.75 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 116.96 1.544 . . . . 10.0 116.96 163.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.422 ' HB2' ' HE ' ' A' ' 38' ' ' ARG . 28.1 mm100 -71.13 -7.12 44.4 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.396 1.998 . . . . 10.0 116.396 -167.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.45 134.87 96.13 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.445 1.475 . . . . 10.0 111.275 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -76.77 155.67 34.97 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.014 1.809 . . . . 10.0 111.774 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 21.99 68.01 0.02 OUTLIER Glycine 0 CA--C 1.536 1.363 0 C-N-CA 128.765 3.079 . . . . 10.0 116.67 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -147.62 -42.58 0.17 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.673 0.99 . . . . 10.0 113.673 -172.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 m 60.02 83.76 0.13 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.159 2.184 . . . . 10.0 114.049 170.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -115.46 115.5 26.64 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 126.063 1.745 . . . . 10.0 112.86 -172.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.5 t 50.18 175.87 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.187 2.195 . . . . 10.0 115.119 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -78.49 -69.66 0.55 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.0 1.72 . . . . 10.0 112.316 161.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.36 -30.31 68.29 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.668 1.587 . . . . 10.0 114.21 -157.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.98 -63.42 1.16 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 119.008 0.822 . . . . 10.0 110.668 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -52.13 -43.16 63.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 119.082 -0.485 . . . . 10.0 110.432 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.67 -32.04 73.38 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.622 2.082 . . . . 10.0 116.622 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -54.43 -35.34 62.85 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.816 1.644 . . . . 10.0 113.673 -170.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.26 -9.49 47.67 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.56 1.552 . . . . 10.0 115.646 168.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.8 pp -63.0 159.93 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 126.336 1.854 . . . . 10.0 112.619 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -9.6 58.5 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.415 1.486 . . . . 10.0 114.936 -169.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.5 m95 45.28 97.42 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.556 2.742 . . . . 10.0 114.012 -162.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -161.59 -178.83 6.84 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.168 1.387 . . . . 10.0 109.917 -169.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -61.21 -29.62 69.93 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.667 1.729 . . . . 10.0 115.667 -155.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.49 -51.15 31.01 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 122.299 2.318 . . . . 10.0 111.484 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.4 p -72.32 -40.53 67.4 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.274 1.429 . . . . 10.0 113.153 -174.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.26 -30.24 64.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.977 0.911 . . . . 10.0 111.88 174.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 36.8 ttm -67.81 -48.7 65.5 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.493 -0.765 . . . . 10.0 109.565 169.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -54.3 -44.75 72.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.876 0.762 . . . . 10.0 110.916 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -69.39 -55.95 8.87 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.401 -0.809 . . . . 10.0 112.659 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.51 -11.03 60.49 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 120.814 1.643 . . . . 10.0 114.379 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -84.72 -29.46 25.53 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 120.507 1.503 . . . . 10.0 112.854 163.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.5 75.61 1.81 Allowed Pre-proline 0 CA--C 1.558 1.267 0 CA-C-N 119.106 0.866 . . . . 10.0 113.002 -172.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -71.3 -56.77 0.11 Allowed 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.486 2.124 . . . . 10.0 112.824 -163.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -65.02 -17.54 64.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.028 1.331 . . . . 10.0 113.905 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -76.34 -49.5 16.7 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.265 1.426 . . . . 10.0 111.586 165.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -62.93 -34.35 77.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.421 0.897 . . . . 10.0 113.421 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.84 125.45 7.46 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.393 1.477 . . . . 10.0 110.66 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.85 169.01 21.34 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.636 2.224 . . . . 10.0 112.657 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.31 -104.46 1.28 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.458 -1.457 . . . . 10.0 109.458 -166.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.4 m 59.93 -39.67 0.09 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 129.217 3.007 . . . . 10.0 118.364 165.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 59.97 -57.59 0.07 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 128.237 2.615 . . . . 10.0 116.311 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt -3.7 87.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 129.824 3.25 . . . . 10.0 113.772 -168.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.9 mp -77.23 70.4 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 125.82 1.648 . . . . 10.0 109.884 -166.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -163.01 -27.08 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.852 1.661 . . . . 10.0 113.02 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.86 -12.57 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 121.136 3.754 . . . . 10.0 121.136 172.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.34 -142.73 3.46 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 120.688 1.585 . . . . 10.0 111.808 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -144.71 165.12 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.805 0.842 . . . . 10.0 109.912 159.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mmpt? -67.82 -21.33 65.22 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.852 1.797 . . . . 10.0 115.852 -167.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -163.07 140.68 7.84 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.416 1.486 . . . . 10.0 109.703 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -54.94 -41.79 71.49 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 116.09 1.885 . . . . 10.0 116.09 -159.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -46.08 64.1 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.144 0.977 . . . . 10.0 111.159 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -58.03 -25.8 61.62 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.033 0.933 . . . . 10.0 112.305 -173.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -29.05 59.85 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.853 0.861 . . . . 10.0 113.317 174.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -72.17 -47.19 52.66 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.592 1.157 . . . . 10.0 110.24 169.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.35 -39.41 79.44 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.647 1.179 . . . . 10.0 112.332 174.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.56 -48.45 79.31 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 168.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.7 mm -60.43 -45.14 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 119.078 0.854 . . . . 10.0 109.823 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.74 80.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.097 0.559 . . . . 10.0 112.453 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.7 -60.38 3.93 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.208 1.003 . . . . 10.0 112.075 174.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.27 -24.52 65.79 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -171.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -57.72 -55.02 40.25 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.884 0.765 . . . . 10.0 111.208 165.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -67.28 -33.19 74.78 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 117.853 -1.07 . . . . 10.0 113.505 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.12 -12.36 2.14 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.619 1.341 . . . . 10.0 114.619 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 47.2 p -76.63 -11.16 59.81 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.191 1.397 . . . . 10.0 114.209 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.26 9.45 0.42 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.048 1.339 . . . . 10.0 114.559 -168.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.973 2.909 . . . . 10.0 109.138 -174.054 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.427 0 CA-C-O 119.324 -0.709 . . . . 10.0 112.753 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' H ' ' HA ' ' A' ' 93' ' ' ASP . 1.0 OUTLIER -123.39 105.26 9.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 117.893 0.846 . . . . 10.0 109.671 -155.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.9 t -46.4 -48.98 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.57 1.548 . . . . 10.0 111.819 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -66.21 -34.7 78.62 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.096 1.358 . . . . 10.0 113.207 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -73.21 -31.64 64.29 Favored 'General case' 0 C--O 1.23 0.063 0 C-N-CA 123.803 0.841 . . . . 10.0 111.754 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.54 -42.14 56.06 Favored Glycine 0 C--O 1.226 -0.349 0 N-CA-C 109.588 -1.405 . . . . 10.0 109.588 -171.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -55.67 -48.16 75.51 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 171.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.65 66.83 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.685 0.994 . . . . 10.0 113.685 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.77 -40.18 76.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 119.658 1.117 . . . . 10.0 110.837 169.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.2 -55.17 30.54 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.709 0.686 . . . . 10.0 109.94 175.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.54 -8.83 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -96.63 -47.57 5.86 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.194 1.398 . . . . 10.0 111.567 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -117.58 -8.33 10.96 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.067 1.506 . . . . 10.0 115.067 -168.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -115.98 -44.56 2.91 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.582 1.553 . . . . 10.0 110.93 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.24 -8.07 5.18 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.81 1.041 . . . . 10.0 113.81 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.57 -15.51 58.27 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.477 1.511 . . . . 10.0 113.057 166.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.2 m -143.92 -44.87 0.27 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.934 1.694 . . . . 10.0 113.037 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -85.72 -164.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.768 2.027 . . . . 10.0 110.593 171.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 20' ' ' VAL . 1.4 t -150.19 -77.06 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.528 1.131 . . . . 10.0 111.153 168.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.505 ' H ' HG23 ' A' ' 19' ' ' THR 0.268 0.9 OUTLIER 49.75 -18.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 129.699 3.2 . . . . 10.0 117.204 -171.812 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -68.42 51.21 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 129.336 3.054 . . . . 10.0 113.315 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 mttm 57.71 -21.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 129.466 3.106 . . . . 10.0 117.013 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.69 75.64 1.43 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 126.501 2.0 . . . . 10.0 112.637 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -53.69 101.19 0.08 OUTLIER Glycine 0 CA--C 1.534 1.223 0 C-N-CA 126.135 1.826 . . . . 10.0 114.745 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -164.81 65.99 0.14 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.389 1.876 . . . . 10.0 112.082 -167.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.562 ' CD2' ' H ' ' A' ' 26' ' ' HIS . 1.7 p80 -64.39 115.48 5.14 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 167.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -142.14 -25.59 0.66 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.968 0.907 . . . . 10.0 113.348 -164.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 m -153.01 -19.59 0.15 Allowed 'General case' 0 N--CA 1.477 0.897 0 O-C-N 120.794 -1.191 . . . . 10.0 111.884 167.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.06 150.85 17.27 Favored Glycine 0 CA--C 1.546 2.02 0 C-N-CA 124.666 1.127 . . . . 10.0 111.689 161.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -78.4 38.98 0.73 Allowed 'Trans proline' 0 CA--C 1.542 0.911 1 C-N-CA 125.354 4.036 . . . . 10.0 116.634 -163.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 56.42 -163.37 0.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.646 -1.284 . . . . 10.0 110.22 -161.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.56 27.44 1.53 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.28 1.832 . . . . 10.0 111.577 172.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.14 107.26 0.22 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 127.635 2.374 . . . . 10.0 114.339 -176.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.03 11.34 58.35 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 126.084 1.802 . . . . 10.0 115.045 173.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 161.89 4.21 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.174 0.987 . . . . 10.0 110.403 166.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 62.77 44.43 6.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.564 1.546 . . . . 10.0 113.121 -155.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 164.08 -44.13 0.31 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.452 1.501 . . . . 10.0 111.034 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.405 HH21 ' HB3' ' A' ' 42' ' ' GLN . 25.0 mtp85 -82.24 159.09 23.29 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.411 0.624 . . . . 10.0 111.495 169.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -85.36 164.92 17.66 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.96 1.304 . . . . 10.0 111.66 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.9 t -60.65 151.35 29.35 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.882 1.273 . . . . 10.0 111.787 171.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.36 8.44 49.85 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 117.154 1.622 . . . . 10.0 117.154 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.552 ' NE2' ' H ' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -65.87 -15.73 63.19 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 115.604 1.705 . . . . 10.0 115.604 -171.258 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.38 109.43 1.37 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.452 1.901 . . . . 10.0 114.868 -162.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.04 52.92 3.99 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.469 3.446 . . . . 10.0 112.395 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 126.94 73.84 0.19 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.498 1.523 . . . . 10.0 112.328 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -157.2 -79.94 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.918 0.887 . . . . 10.0 111.485 171.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 24.7 m 55.28 102.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.511 1.525 . . . . 10.0 112.176 -155.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -55.03 4.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.582 1.953 . . . . 10.0 110.305 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 71.9 p -144.69 175.81 9.89 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.216 2.606 . . . . 10.0 108.04 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -76.6 -60.48 2.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.804 1.642 . . . . 10.0 112.84 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.16 -52.45 65.29 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.766 1.226 . . . . 10.0 113.883 -153.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -58.82 -58.87 6.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.599 0.76 . . . . 10.0 112.885 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -39.95 76.34 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.528 1.131 . . . . 10.0 113.139 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -61.67 -34.91 76.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.178 0.899 . . . . 10.0 113.241 173.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -75.13 -10.99 59.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 115.118 1.525 . . . . 10.0 115.118 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.06 12.29 57.23 Favored Glycine 0 CA--C 1.542 1.781 0 N-CA-C 117.663 1.825 . . . . 10.0 117.663 163.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -55.4 4.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 119.449 3.129 . . . . 10.0 119.449 -161.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 m 55.62 104.58 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.825 2.45 . . . . 10.0 114.625 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.425 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 9.1 m95 -72.53 119.49 16.82 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 121.182 -0.949 . . . . 10.0 111.777 171.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.3 tttm -163.81 167.84 20.34 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.593 1.157 . . . . 10.0 111.146 -155.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -68.61 23.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.81 2.844 . . . . 10.0 114.427 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -158.91 17.48 0.19 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.895 2.878 . . . . 10.0 110.651 -168.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.7 p -158.45 -37.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.244 1.818 . . . . 10.0 110.656 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.64 HD22 HH12 ' A' ' 91' ' ' ARG . 1.0 OUTLIER -75.38 -22.27 57.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 114.424 1.268 . . . . 10.0 114.424 174.636 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.7 mtm -67.76 -52.73 33.93 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.88 0.763 . . . . 10.0 110.686 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -61.97 -41.47 98.04 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.46 0.475 . . . . 10.0 110.527 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.76 -53.23 43.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 113.316 0.858 . . . . 10.0 113.316 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.7 tp -65.96 -33.47 75.9 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.062 1.301 . . . . 10.0 112.415 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -70.34 -28.3 65.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 172.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -161.38 75.94 2.42 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.626 1.17 . . . . 10.0 112.353 -172.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.99 -48.68 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.612 2.208 . . . . 10.0 111.93 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 32.38 0.08 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.35 2.26 . . . . 10.0 114.268 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.26 -43.65 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 128.006 2.522 . . . . 10.0 110.45 -167.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -68.06 -36.82 80.5 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 174.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.44 143.55 41.57 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.702 0.801 . . . . 10.0 111.224 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -76.72 158.75 35.4 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.151 2.568 . . . . 10.0 111.379 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 57.49 55.8 28.5 Favored Glycine 0 C--N 1.34 0.778 0 C-N-CA 123.868 0.747 . . . . 10.0 112.044 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -126.68 151.01 48.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.125 1.77 . . . . 10.0 109.445 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -142.55 5.92 1.63 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.332 1.453 . . . . 10.0 113.87 -169.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -54.75 92.64 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.746 1.618 . . . . 10.0 113.035 173.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.77 83.22 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.484 1.514 . . . . 10.0 110.069 175.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -162.3 -53.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.069 0.766 . . . . 10.0 113.069 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.71 87.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.078 2.551 . . . . 10.0 117.254 168.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.78 95.87 1.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 123.374 0.511 . . . . 10.0 112.134 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.65 -21.11 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -166.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 73.63 148.33 0.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.162 2.585 . . . . 10.0 110.943 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm 46.95 -13.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 130.554 3.541 . . . . 10.0 118.298 -162.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.6 mttm 49.11 -9.72 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 131.406 3.882 . . . . 10.0 118.754 163.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.0 m -63.9 -26.77 68.75 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 122.726 2.512 . . . . 10.0 111.188 156.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -53.29 -33.32 52.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.195 0.998 . . . . 10.0 112.955 163.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.64 HH12 HD22 ' A' ' 64' ' ' LEU . 3.9 tpm_? -66.59 -44.49 82.02 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 116.981 -1.485 . . . . 10.0 110.404 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.17 -45.42 93.15 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.419 1.009 . . . . 10.0 110.335 177.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.424 ' HA ' ' H ' ' A' ' 2' ' ' ASP . 77.2 m-20 -59.79 -49.42 77.8 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.467 1.507 . . . . 10.0 110.911 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.95 -40.95 97.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.469 0.914 . . . . 10.0 113.469 174.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.8 mm -54.71 -56.2 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 171.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.54 42.76 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.028 0.931 . . . . 10.0 111.075 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.446 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 9.2 t80 -52.0 -59.11 4.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.081 1.752 . . . . 10.0 112.36 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.446 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 15.1 mt -71.51 -30.91 66.48 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.946 0.794 . . . . 10.0 113.01 -175.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -61.43 -52.97 62.37 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 118.995 0.816 . . . . 10.0 109.862 171.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -37.72 82.51 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 117.453 -1.26 . . . . 10.0 113.189 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.73 -7.18 4.45 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.013 1.486 . . . . 10.0 115.013 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.8 p -69.41 -16.92 63.6 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.883 -1.136 . . . . 10.0 113.538 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -153.61 43.73 0.59 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.77 1.228 . . . . 10.0 111.8 -162.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 129.635 3.174 . . . . 10.0 110.506 163.276 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.425 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.019 0 N-CA-C 109.693 -1.363 . . . . 10.0 109.693 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -109.33 150.56 27.82 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.147 0.979 . . . . 10.0 111.562 -174.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.6 m -70.8 -40.27 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 121.244 -0.91 . . . . 10.0 112.24 -174.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 mp0 -59.12 -51.84 68.3 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.425 1.49 . . . . 10.0 110.288 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -56.93 -21.61 31.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.995 1.718 . . . . 10.0 114.167 174.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -95.74 -43.04 3.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 119.074 0.852 . . . . 10.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -60.8 -42.04 96.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.797 1.298 . . . . 10.0 112.757 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -36.51 81.8 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.55 1.14 . . . . 10.0 112.627 -176.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.569 HG23 HD11 ' A' ' 94' ' ' LEU . 9.8 tp -85.99 -34.53 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 124.059 0.944 . . . . 10.0 111.217 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -57.35 -50.88 71.54 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 118.929 0.786 . . . . 10.0 110.318 171.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.4 t -65.01 -8.1 5.05 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -97.67 -48.69 5.13 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.241 1.417 . . . . 10.0 112.56 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' HD11 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -121.75 -0.24 9.68 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.391 1.626 . . . . 10.0 115.391 -171.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.2 m -117.61 -43.47 2.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.862 1.265 . . . . 10.0 111.655 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.88 -10.09 8.47 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -16.62 52.6 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 10.0 112.854 167.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.1 m -143.24 -34.82 0.41 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.468 1.507 . . . . 10.0 114.002 -175.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -105.45 174.25 5.96 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.362 2.665 . . . . 10.0 111.837 -178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.0 m -160.92 90.29 0.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 119.735 -1.853 . . . . 10.0 112.732 170.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.8 p -95.76 -36.26 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 N-CA-C 114.103 1.149 . . . . 10.0 114.103 171.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.96 -0.73 12.22 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.838 -1.164 . . . . 10.0 114.061 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -151.54 -166.27 2.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.057 2.543 . . . . 10.0 107.115 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -66.24 53.81 0.18 Allowed Glycine 0 CA--C 1.541 1.692 0 N-CA-C 118.058 1.983 . . . . 10.0 118.058 -167.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.85 8.01 56.63 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 117.54 1.776 . . . . 10.0 117.54 156.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -64.57 159.48 21.69 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.348 1.059 . . . . 10.0 112.42 -173.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -152.41 91.29 1.57 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.753 1.621 . . . . 10.0 108.259 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -96.58 -29.21 13.98 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.703 1.601 . . . . 10.0 113.194 -167.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 91.1 m -154.1 -20.04 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 O-C-N 120.963 -1.086 . . . . 10.0 111.903 176.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -116.97 171.67 13.9 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 110.499 -1.04 . . . . 10.0 110.499 154.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -61.65 178.98 0.56 Allowed 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.846 5.031 . . . . 10.0 114.167 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -83.53 -10.24 58.43 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.325 1.602 . . . . 10.0 115.325 -168.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.4 mp 45.5 69.42 0.45 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.618 1.167 . . . . 10.0 110.59 -158.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.413 ' CE1' HH21 ' A' ' 38' ' ' ARG . 0.5 OUTLIER -55.56 -179.24 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.64 1.176 . . . . 10.0 111.51 163.19 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -36.53 137.92 0.45 Allowed Glycine 0 CA--C 1.538 1.523 0 O-C-N 121.491 -0.756 . . . . 10.0 112.356 161.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -151.86 171.74 17.27 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 130.064 3.346 . . . . 10.0 109.097 -167.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 68.38 86.19 0.13 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.03 1.732 . . . . 10.0 112.784 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.4 60.71 1.43 Allowed Glycine 0 CA--C 1.527 0.809 0 CA-C-N 115.016 -0.993 . . . . 10.0 112.989 172.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.413 HH21 ' CE1' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -152.21 -94.26 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.494 1.118 . . . . 10.0 110.328 172.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -154.5 -129.41 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.651 1.18 . . . . 10.0 110.608 165.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.9 t -158.63 167.69 28.89 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 128.33 2.652 . . . . 10.0 108.082 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.18 46.29 4.17 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 115.98 1.152 . . . . 10.0 115.98 174.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -128.94 1.0 5.32 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.651 1.723 . . . . 10.0 115.651 -173.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.85 116.91 27.39 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 120.855 1.661 . . . . 10.0 112.225 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.83 -39.25 0.69 Allowed 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.495 2.13 . . . . 10.0 114.197 -158.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -119.15 49.08 0.89 Allowed Glycine 0 C--N 1.34 0.788 0 C-N-CA 124.439 1.018 . . . . 10.0 112.322 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -141.72 -41.04 0.36 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 118.384 -0.817 . . . . 10.0 113.172 -172.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 t 43.91 87.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.493 1.917 . . . . 10.0 115.297 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -172.9 4.03 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 126.647 1.979 . . . . 10.0 113.283 -172.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.7 p -64.13 155.45 31.49 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.222 -0.924 . . . . 10.0 111.793 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.18 -50.39 16.39 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.847 2.059 . . . . 10.0 112.41 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.32 30.64 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 128.379 2.672 . . . . 10.0 116.464 -164.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -161.23 -70.16 0.06 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.039 3.336 . . . . 10.0 107.145 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -55.3 22.59 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.997 1.719 . . . . 10.0 112.555 178.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.9 -32.34 73.8 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.269 0.94 . . . . 10.0 112.021 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -60.66 -16.56 40.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.011 1.325 . . . . 10.0 113.337 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.68 14.93 79.51 Favored Glycine 0 CA--C 1.535 1.308 0 N-CA-C 115.914 1.126 . . . . 10.0 115.914 163.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -55.45 0.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.219 2.607 . . . . 10.0 117.993 -167.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.8 m 55.47 107.51 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 128.941 2.896 . . . . 10.0 115.161 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -67.82 131.63 45.88 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.747 0.784 . . . . 10.0 112.576 170.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -165.1 162.66 20.35 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.348 1.459 . . . . 10.0 110.682 -155.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.35 35.28 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 129.399 3.08 . . . . 10.0 113.602 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -162.06 -74.54 0.05 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 128.235 2.614 . . . . 10.0 107.578 -164.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.4 p -57.88 -37.03 73.24 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.064 2.145 . . . . 10.0 112.582 -176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.42 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.92 -23.61 55.49 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.765 1.226 . . . . 10.0 113.68 176.024 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 35.7 mtm -71.99 -48.27 46.05 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.65 -0.656 . . . . 10.0 109.948 170.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -57.5 -51.79 68.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.657 1.183 . . . . 10.0 110.829 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -59.3 -52.03 67.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 118.308 -0.853 . . . . 10.0 112.44 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.404 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -63.36 -48.04 79.59 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.591 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HA ' ' HA2' ' A' ' 84' ' ' GLY . 14.1 mm-40 -62.6 -29.13 70.37 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.27 1.211 . . . . 10.0 114.27 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -162.25 97.71 1.17 Allowed Pre-proline 0 CA--C 1.546 0.8 0 CA-C-N 119.156 0.889 . . . . 10.0 112.01 161.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.14 -49.22 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.398 2.065 . . . . 10.0 110.838 -172.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -61.4 -23.19 65.63 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.956 1.702 . . . . 10.0 113.775 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -52.56 9.54 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.028 1.331 . . . . 10.0 112.273 163.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -61.85 -32.38 72.71 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.122 0.786 . . . . 10.0 113.122 -175.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.54 148.0 54.42 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 126.077 1.751 . . . . 10.0 110.82 172.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.42 -8.45 19.59 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.94 2.427 . . . . 10.0 114.094 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -141.25 78.52 0.29 Allowed Glycine 0 C--N 1.34 0.763 0 C-N-CA 123.938 0.78 . . . . 10.0 113.126 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.7 m -133.91 119.46 19.14 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.746 0.818 . . . . 10.0 113.091 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -85.99 6.12 30.18 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 116.016 1.858 . . . . 10.0 116.016 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.57 109.32 0.68 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.438 1.095 . . . . 10.0 111.364 173.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 26.0 mm -83.74 77.31 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 124.999 1.319 . . . . 10.0 110.035 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -163.85 -42.74 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.273 0.842 . . . . 10.0 113.273 167.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.67 -146.19 0.2 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.296 1.038 . . . . 10.0 113.198 -162.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 69' ' ' GLU . . . -57.0 150.26 28.86 Favored Glycine 0 C--N 1.343 0.949 0 C-N-CA 124.607 1.099 . . . . 10.0 115.479 -163.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 tt -69.58 -9.86 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.552 1.316 . . . . 10.0 114.552 -163.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.2 tttm 56.68 51.11 11.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.686 1.994 . . . . 10.0 111.716 -178.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.31 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.046 1.738 . . . . 10.0 115.235 175.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 mptt 47.5 -56.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 129.441 3.096 . . . . 10.0 116.351 -162.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.5 m -58.66 -37.61 76.36 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 121.358 1.89 . . . . 10.0 112.495 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -52.75 -38.47 60.96 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.356 0.662 . . . . 10.0 111.86 171.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.42 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -61.17 -46.69 89.48 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.839 -1.163 . . . . 10.0 110.932 -178.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.95 -22.77 55.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.783 1.031 . . . . 10.0 113.783 175.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -62.85 -49.76 73.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.813 1.188 . . . . 10.0 110.264 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.569 HD11 HG23 ' A' ' 9' ' ' ILE . 3.6 mp -59.51 -40.58 87.58 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.148 -0.97 . . . . 10.0 113.29 174.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.59 -48.79 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 119.053 0.842 . . . . 10.0 109.022 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -50.23 74.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.101 0.409 . . . . 10.0 111.344 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -53.71 -55.73 23.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.006 1.323 . . . . 10.0 112.847 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.97 -28.71 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.326 0.966 . . . . 10.0 112.608 -175.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -66.63 -18.96 65.65 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.376 1.071 . . . . 10.0 112.625 171.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -85.95 -58.19 2.74 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 117.223 -1.37 . . . . 10.0 111.377 158.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.16 -18.62 37.85 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 115.948 1.833 . . . . 10.0 115.948 -170.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.2 t -64.19 -19.97 65.7 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.011 1.324 . . . . 10.0 114.509 166.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.22 -4.21 0.2 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 116.538 2.051 . . . . 10.0 116.538 -167.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 C--O 1.25 1.095 0 C-N-CA 126.155 1.782 . . . . 10.0 111.274 -171.525 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 CA-C-O 118.111 -1.383 . . . . 10.0 114.828 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -80.7 163.98 23.15 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.606 1.703 . . . . 10.0 111.442 166.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.03 -50.3 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.678 1.191 . . . . 10.0 110.597 159.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.36 -49.95 65.16 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.951 -1.093 . . . . 10.0 113.114 -170.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -57.29 -32.1 66.3 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.732 0.413 . . . . 10.0 111.527 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.34 -41.74 58.32 Favored Glycine 0 C--N 1.34 0.754 0 C-N-CA 124.535 1.064 . . . . 10.0 111.287 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -69.7 -33.8 73.02 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 118.15 0.975 . . . . 10.0 111.978 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -53.58 55.9 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.932 1.293 . . . . 10.0 110.311 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.96 -33.19 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 118.61 -0.709 . . . . 10.0 112.696 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.7 t80 -56.59 -54.08 50.18 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 119.725 1.148 . . . . 10.0 110.723 170.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.87 -10.09 6.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 112.932 0.715 . . . . 10.0 112.932 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -90.06 -52.32 5.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.195 1.398 . . . . 10.0 111.354 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -134.55 10.12 3.7 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -167.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.0 m -113.26 -42.29 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.11 1.364 . . . . 10.0 110.719 167.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.35 -14.61 19.54 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -66.13 -10.28 39.41 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.923 1.689 . . . . 10.0 114.741 168.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -143.43 -34.68 0.4 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.76 1.224 . . . . 10.0 112.98 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -114.41 -175.42 2.68 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.597 2.359 . . . . 10.0 111.956 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -146.04 176.74 9.49 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.317 0.647 . . . . 10.0 110.756 151.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.3 p -162.34 -41.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 127.139 2.176 . . . . 10.0 109.765 156.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -67.47 -51.9 45.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.996 0.918 . . . . 10.0 111.091 166.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -85.26 82.87 8.19 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.5 1.12 . . . . 10.0 110.158 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.7 -73.69 0.16 Allowed Glycine 0 CA--C 1.534 1.23 0 C-N-CA 127.341 2.401 . . . . 10.0 115.757 167.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 154.6 114.93 0.53 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.122 1.344 . . . . 10.0 111.984 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -163.86 157.26 18.59 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.707 2.003 . . . . 10.0 110.747 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -156.19 108.16 2.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.744 2.018 . . . . 10.0 107.369 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -144.27 -82.08 0.17 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.286 1.034 . . . . 10.0 110.866 -167.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.495 ' O ' HMD3 ' A' ' 105' ' ' HEC . 0.4 OUTLIER -79.71 -23.76 42.15 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 117.984 0.356 . . . . 10.0 110.957 177.149 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -144.51 175.92 23.97 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 126.814 2.15 . . . . 10.0 110.82 160.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.07 -179.18 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.273 3.982 . . . . 10.0 113.936 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -93.68 16.27 14.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.347 2.659 . . . . 10.0 115.741 -169.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp 38.85 55.1 2.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.99 2.116 . . . . 10.0 112.924 -176.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -56.94 84.73 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 128.595 2.758 . . . . 10.0 114.112 -178.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.25 32.19 60.07 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.413 1.482 . . . . 10.0 114.962 166.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.0 179.25 0.71 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.183 0.993 . . . . 10.0 113.429 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.604 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 4.1 m-85 52.81 42.95 31.98 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 124.802 1.241 . . . . 10.0 111.068 -166.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 1.68 0.07 OUTLIER Glycine 0 CA--C 1.542 1.77 0 C-N-CA 126.945 2.212 . . . . 10.0 115.208 -163.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.9 mtp85 -152.41 163.33 39.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.118 1.767 . . . . 10.0 110.848 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -83.72 172.76 11.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.02 2.128 . . . . 10.0 112.999 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 50.6 p -81.73 179.63 7.75 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.581 1.152 . . . . 10.0 112.125 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.72 -32.1 4.07 Favored Glycine 0 CA--C 1.529 0.956 0 O-C-N 120.88 -1.137 . . . . 10.0 114.5 176.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 44.3 mm-40 -64.98 6.32 0.25 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 128.708 2.803 . . . . 10.0 116.623 -161.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.17 145.0 79.76 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 119.405 1.002 . . . . 10.0 108.939 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.57 70.31 4.97 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.415 2.743 . . . . 10.0 111.323 -177.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.35 -79.27 0.23 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.918 1.723 . . . . 10.0 111.987 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 48.62 -14.33 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 130.438 3.495 . . . . 10.0 117.883 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 m 76.38 75.82 0.09 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 129.787 3.235 . . . . 10.0 112.025 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -84.27 170.0 14.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.943 1.297 . . . . 10.0 111.849 159.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 82.1 p -69.59 -1.37 8.64 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 116.226 1.936 . . . . 10.0 116.226 -172.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.4 t70 46.3 -157.33 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.456 0.702 . . . . 10.0 110.912 -146.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.25 -76.12 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.357 2.663 . . . . 10.0 113.147 -168.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -49.94 -71.64 0.06 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.212 1.805 . . . . 10.0 111.4 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.514 ' HZ2' ' CGA' ' A' ' 105' ' ' HEC . 29.8 mmmt -57.07 -42.3 80.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.616 1.966 . . . . 10.0 111.246 -172.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.11 -59.9 3.61 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.591 2.356 . . . . 10.0 112.525 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -62.29 -52.01 65.41 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.905 0.882 . . . . 10.0 111.552 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.3 -179.99 19.01 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 122.436 1.02 . . . . 10.0 115.203 -172.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.1 pp -171.07 -1.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 128.747 2.819 . . . . 10.0 112.544 -169.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.8 m 55.39 106.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.86 2.064 . . . . 10.0 113.181 -162.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -67.38 123.15 19.57 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.31 -0.869 . . . . 10.0 111.692 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -162.57 178.15 8.81 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.172 2.189 . . . . 10.0 110.907 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.91 41.93 0.05 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.127 2.971 . . . . 10.0 113.344 -174.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -161.64 -64.45 0.05 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.563 3.145 . . . . 10.0 108.396 -176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.1 p -62.48 -43.81 97.92 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.176 1.39 . . . . 10.0 112.416 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.69 -25.3 60.17 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.131 0.573 . . . . 10.0 111.405 173.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 34.3 ttm -63.95 -52.42 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.204 0.911 . . . . 10.0 109.234 170.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -60.86 -44.67 96.7 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.499 0.72 . . . . 10.0 111.146 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.29 -48.27 76.31 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.499 -0.762 . . . . 10.0 111.674 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -42.16 99.01 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.079 1.308 . . . . 10.0 111.066 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.97 -45.51 74.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.107 0.867 . . . . 10.0 112.282 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -160.6 76.77 2.62 Favored Pre-proline 0 CA--C 1.559 1.307 0 C-N-CA 124.656 1.182 . . . . 10.0 111.034 -163.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.92 -67.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.473 3.449 . . . . 10.0 114.271 -161.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -58.64 -20.29 46.56 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.176 1.79 . . . . 10.0 113.233 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -48.06 24.58 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.828 2.051 . . . . 10.0 111.428 170.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -61.19 -41.1 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.629 0.772 . . . . 10.0 112.855 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 pt -139.53 135.89 17.29 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.711 0.805 . . . . 10.0 111.208 -175.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -78.37 65.92 8.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.438 3.425 . . . . 10.0 112.786 -168.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.36 -145.96 4.65 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 126.423 1.963 . . . . 10.0 109.614 175.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 93.0 m 74.86 147.6 0.09 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.065 2.146 . . . . 10.0 114.636 168.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -141.56 21.6 2.18 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.946 2.098 . . . . 10.0 111.666 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 21.7 ttt -59.49 98.6 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.156 1.382 . . . . 10.0 109.561 158.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.5 mp -75.57 57.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.262 1.025 . . . . 10.0 110.3 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -163.64 107.05 0.99 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.29 1.036 . . . . 10.0 111.417 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.89 -162.04 0.2 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.096 1.358 . . . . 10.0 111.942 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.26 60.26 0.01 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 127.58 2.514 . . . . 10.0 117.051 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.331 5.6 tt 44.71 -122.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.343 2.657 . . . . 10.0 112.042 175.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -142.31 -73.8 0.3 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.31 1.444 . . . . 10.0 110.15 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.81 115.52 3.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 161.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -64.04 -21.71 66.62 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.133 0.879 . . . . 10.0 111.373 170.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.7 m -53.1 -50.91 63.46 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.145 0.978 . . . . 10.0 112.339 164.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.25 -30.36 66.49 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.551 1.069 . . . . 10.0 111.341 176.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -19.57 59.48 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.545 1.138 . . . . 10.0 113.869 173.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.76 -62.97 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.398 1.454 . . . . 10.0 108.189 160.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.58 -48.48 72.05 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 126.458 1.903 . . . . 10.0 111.198 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.2 tp -60.44 -47.7 84.96 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.7 mm -65.57 -44.02 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.905 -0.497 . . . . 10.0 110.075 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.53 -35.39 80.33 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.217 1.007 . . . . 10.0 111.609 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.445 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.0 t80 -57.12 -66.44 0.45 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.675 1.19 . . . . 10.0 110.952 165.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 51.7 mt -62.86 -29.9 71.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.604 ' HE2' ' HB3' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -57.46 -46.92 83.11 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.54 1.064 . . . . 10.0 110.983 172.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -91.22 -38.24 12.82 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 117.983 -1.008 . . . . 10.0 111.684 -172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.71 -13.33 9.53 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.837 1.655 . . . . 10.0 115.013 175.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.58 -2.38 14.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.581 1.152 . . . . 10.0 113.346 168.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -151.4 -53.8 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.73 2.012 . . . . 10.0 111.816 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 126.697 1.999 . . . . 10.0 113.215 -178.176 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.514 ' CGA' ' HZ2' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.768 0 CA-C-O 118.716 -1.047 . . . . 10.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -136.82 155.2 50.11 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.475 0.917 . . . . 10.0 113.475 -144.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 94.6 t -58.57 -56.09 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 126.183 1.793 . . . . 10.0 111.544 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -59.46 -36.46 75.99 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.37 1.468 . . . . 10.0 112.004 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -77.75 -8.97 58.73 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.221 1.808 . . . . 10.0 114.666 174.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.23 -41.47 5.51 Favored Glycine 0 N--CA 1.471 1.0 0 CA-C-N 119.707 1.14 . . . . 10.0 112.092 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.08 68.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.726 -0.867 . . . . 10.0 113.036 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -30.07 67.71 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.492 1.293 . . . . 10.0 114.492 177.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 tp -86.11 -31.1 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 119.026 0.83 . . . . 10.0 110.325 173.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t80 -58.08 -52.02 67.26 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 122.072 -0.393 . . . . 10.0 111.336 169.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.86 -9.89 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.366 0.876 . . . . 10.0 113.366 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -82.55 -52.18 7.08 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.055 0.942 . . . . 10.0 110.742 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -116.06 -52.67 2.59 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.285 1.034 . . . . 10.0 112.595 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 9.5 m -59.53 -43.01 93.59 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.902 0.881 . . . . 10.0 112.666 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.417 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -62.9 -12.2 23.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.658 1.355 . . . . 10.0 114.658 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.88 -14.77 63.11 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.618 1.099 . . . . 10.0 112.252 170.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 91.7 m -143.03 -26.95 0.58 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.665 1.358 . . . . 10.0 114.665 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.426 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.4 m-70 -109.54 -56.26 2.33 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.201 1.4 . . . . 10.0 114.127 -174.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.417 ' H ' ' HA ' ' A' ' 15' ' ' ALA 0.294 9.8 t 44.67 53.31 7.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.187 1.795 . . . . 10.0 114.016 -175.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.71 -28.38 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 120.789 -1.194 . . . . 10.0 112.752 175.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.82 4.74 0.26 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.542 1.937 . . . . 10.0 114.712 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -149.79 13.57 0.81 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.75 2.42 . . . . 10.0 111.501 169.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.2 40.23 51.93 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.86 1.219 . . . . 10.0 112.957 -173.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.49 179.28 53.17 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 123.079 1.377 . . . . 10.0 114.52 -165.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -56.73 111.81 1.12 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.265 1.426 . . . . 10.0 113.057 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -68.02 61.01 0.08 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.61 1.964 . . . . 10.0 111.846 170.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -82.64 -19.99 37.17 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.269 1.827 . . . . 10.0 112.821 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.3 m -153.74 -18.93 0.14 Allowed 'General case' 0 N--CA 1.479 0.997 0 O-C-N 120.983 -1.073 . . . . 10.0 113.332 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -128.99 165.82 21.65 Favored Glycine 0 CA--C 1.54 1.656 0 CA-C-N 119.645 1.111 . . . . 10.0 110.99 157.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 49.3 Cg_endo -67.96 22.86 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.045 1 C-N-CA 126.478 4.785 . . . . 10.0 116.342 -173.728 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.349 0.0 OUTLIER 49.56 6.38 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 128.726 2.811 . . . . 10.0 117.931 -169.561 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.11 -34.21 0.28 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.728 2.411 . . . . 10.0 113.966 171.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.43 68.11 0.17 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 131.148 3.779 . . . . 10.0 114.13 169.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 32.85 68.05 0.18 Allowed Glycine 0 C--N 1.345 1.061 0 C-N-CA 127.587 2.517 . . . . 10.0 113.456 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -93.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.661 0.785 . . . . 10.0 112.322 -164.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 33.86 62.05 0.46 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.749 2.42 . . . . 10.0 115.358 161.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.35 -24.32 16.11 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.095 1.807 . . . . 10.0 114.151 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -68.06 168.18 12.5 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.955 1.378 . . . . 10.0 111.059 164.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -84.96 166.04 17.09 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.082 1.141 . . . . 10.0 114.082 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.4 p -67.55 -71.57 0.2 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 128.42 2.688 . . . . 10.0 112.964 -174.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -73.5 67.7 1.55 Allowed Glycine 0 C--N 1.339 0.703 0 C-N-CA 126.99 2.233 . . . . 10.0 112.988 -171.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.86 -2.98 7.73 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -173.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.06 118.84 59.47 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.551 1.14 . . . . 10.0 111.592 -176.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.89 81.75 1.86 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.069 2.513 . . . . 10.0 113.088 -171.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.96 -7.75 70.09 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 125.403 1.478 . . . . 10.0 115.249 170.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -64.37 113.72 3.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.047 1.339 . . . . 10.0 110.615 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 m -71.18 142.55 50.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.399 1.48 . . . . 10.0 111.657 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.619 ' CG ' ' HE3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -155.0 178.41 10.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.082 1.142 . . . . 10.0 114.082 -169.221 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 p -67.52 120.93 14.77 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 10.0 111.924 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -75.07 36.38 0.11 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.676 1.59 . . . . 10.0 113.601 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.97 11.45 2.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.128 1.371 . . . . 10.0 114.625 -166.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.66 -33.97 0.05 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 117.905 -1.045 . . . . 10.0 113.791 -168.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HE3' ' CG ' ' A' ' 48' ' ' TYR . 1.7 mppt? -64.48 -48.81 73.83 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.763 1.165 . . . . 10.0 108.071 166.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -49.01 -34.89 14.07 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.133 3.773 . . . . 10.0 113.82 176.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -68.71 -16.36 63.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.832 1.049 . . . . 10.0 113.832 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.94 5.13 57.3 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.296 1.279 . . . . 10.0 116.296 165.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.9 pp -61.24 14.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 128.995 2.918 . . . . 10.0 116.706 -173.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 99.9 m 40.6 81.14 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.568 2.747 . . . . 10.0 112.504 155.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -54.6 137.08 44.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.167 1.387 . . . . 10.0 111.692 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.258 0.0 OUTLIER -161.46 -73.72 0.06 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.734 1.383 . . . . 10.0 114.734 -164.006 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -164.68 20.32 0.06 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 121.145 1.793 . . . . 10.0 113.092 -171.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -160.72 -63.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.963 1.305 . . . . 10.0 107.898 -162.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 46.3 p -60.81 -46.82 89.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 126.979 2.112 . . . . 10.0 110.651 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -28.86 66.47 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.932 1.293 . . . . 10.0 112.324 174.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.7 ttm -65.13 -51.13 63.1 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.053 0.541 . . . . 10.0 109.854 173.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -61.56 -46.18 90.99 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.269 1.028 . . . . 10.0 110.352 176.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.29 -53.01 50.31 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 118.585 -0.721 . . . . 10.0 112.799 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -26.44 66.71 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.257 1.389 . . . . 10.0 111.798 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.53 -25.2 45.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.976 1.473 . . . . 10.0 114.976 169.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.46 72.25 1.87 Allowed Pre-proline 0 CA--C 1.563 1.451 0 CA-C-N 119.746 1.157 . . . . 10.0 113.442 -174.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -71.5 -57.54 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.454 2.103 . . . . 10.0 113.283 -161.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.8 mttm -62.6 -27.88 69.5 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 127.081 2.153 . . . . 10.0 112.456 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.28 -46.62 32.38 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 126.284 1.834 . . . . 10.0 110.764 172.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -61.03 -49.29 78.01 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.271 0.841 . . . . 10.0 113.271 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 pt -135.97 131.29 18.86 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.661 0.784 . . . . 10.0 111.155 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -80.75 64.71 8.92 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.228 3.285 . . . . 10.0 113.33 -159.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 149.85 88.67 0.07 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 123.769 0.699 . . . . 10.0 111.59 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 19.0 m -143.89 100.26 3.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.616 1.166 . . . . 10.0 109.407 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -81.35 7.99 10.26 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.383 1.873 . . . . 10.0 115.0 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.3 ttt -50.14 107.55 0.17 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.106 0.866 . . . . 10.0 110.379 156.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.435 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.0 mp -78.49 59.2 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.936 1.295 . . . . 10.0 110.521 -175.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -162.93 92.44 0.77 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.307 1.043 . . . . 10.0 110.358 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.36 -14.62 60.48 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.453 1.649 . . . . 10.0 115.453 -172.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -179.95 159.09 23.22 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.753 1.168 . . . . 10.0 111.19 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' H ' ' A' ' 86' ' ' LYS 0.315 20.5 tt -96.06 -96.29 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 N-CA-C 114.176 1.176 . . . . 10.0 114.176 -168.255 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.665 ' H ' HG23 ' A' ' 85' ' ' ILE . 9.3 mmpt? -146.83 103.4 3.63 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.017 1.327 . . . . 10.0 110.995 -171.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 47.22 -73.7 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 129.352 3.061 . . . . 10.0 114.421 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -164.18 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.825 1.65 . . . . 10.0 112.931 157.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 m -52.71 -52.29 56.74 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.771 1.228 . . . . 10.0 112.592 -171.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -58.89 -26.37 64.22 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.984 0.811 . . . . 10.0 112.622 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -23.66 58.18 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.559 0.743 . . . . 10.0 112.251 176.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -70.28 -53.89 14.96 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.085 -1.009 . . . . 10.0 110.101 168.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.08 -47.32 78.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 10.0 110.544 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 45.5 tp -56.93 -48.29 78.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.735 1.614 . . . . 10.0 113.821 172.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 15.4 mm -61.69 -44.36 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 118.858 0.754 . . . . 10.0 109.911 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.22 84.05 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.548 0.739 . . . . 10.0 111.82 175.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -55.62 -60.51 3.33 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.52 0.728 . . . . 10.0 111.756 171.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.77 -21.65 62.48 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.794 1.179 . . . . 10.0 113.99 -172.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.76 -59.77 4.26 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.485 0.714 . . . . 10.0 109.989 159.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 mmtt -61.89 -28.23 69.36 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.36 -1.305 . . . . 10.0 113.387 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.72 -13.92 7.24 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.801 1.637 . . . . 10.0 114.698 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.8 p -74.61 -20.58 59.86 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.882 1.438 . . . . 10.0 114.882 166.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -155.8 15.87 0.36 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 115.175 1.546 . . . . 10.0 115.175 -164.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 115.314 -2.279 . . . . 10.0 113.819 173.636 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 111.013 -0.835 . . . . 10.0 111.013 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.06 151.51 28.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.32 2.248 . . . . 10.0 114.404 -163.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -58.13 -35.62 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 120.763 -1.21 . . . . 10.0 113.228 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 -63.81 -48.89 75.06 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.564 1.546 . . . . 10.0 111.216 176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -57.57 -34.11 68.85 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.589 0.755 . . . . 10.0 111.574 172.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.79 -51.61 39.54 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.15 -1.18 . . . . 10.0 110.15 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.259 1.1 ptpm? -64.16 -38.25 90.39 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 118.401 1.101 . . . . 10.0 113.657 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.26 -37.7 78.06 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.595 1.089 . . . . 10.0 113.357 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mm -69.4 -39.99 79.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 120.025 1.284 . . . . 10.0 110.96 172.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -56.38 -49.01 75.69 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.544 -0.723 . . . . 10.0 110.35 174.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.15 -11.59 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.976 1.102 . . . . 10.0 113.976 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -84.95 -33.75 22.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.329 1.051 . . . . 10.0 112.275 -177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -132.02 -63.52 0.81 Allowed 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 126.159 1.784 . . . . 10.0 111.148 -172.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 m -53.64 -47.73 70.05 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.551 1.14 . . . . 10.0 112.784 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.24 -17.57 62.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 114.046 1.128 . . . . 10.0 114.046 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.01 -7.82 32.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.268 1.427 . . . . 10.0 112.781 174.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -141.67 -21.28 0.74 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.613 1.565 . . . . 10.0 113.186 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -126.23 -5.74 6.62 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.568 2.062 . . . . 10.0 116.568 -170.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.2 m 54.94 -79.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.934 2.093 . . . . 10.0 116.193 -177.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.8 t 46.95 -59.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.276 1 C-N-CA 131.711 4.004 . . . . 10.0 116.041 -167.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -71.72 14.05 0.23 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.511 1.924 . . . . 10.0 113.687 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -153.78 -166.53 2.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.474 2.71 . . . . 10.0 108.522 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.99 59.97 0.15 Allowed Glycine 0 CA--C 1.541 1.716 0 C-N-CA 125.552 1.548 . . . . 10.0 116.332 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.7 -1.05 1.29 Allowed Glycine 0 CA--C 1.531 1.085 0 N-CA-C 120.709 3.044 . . . . 10.0 120.709 153.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.01 155.35 8.31 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.972 1.386 . . . . 10.0 112.736 -172.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -152.04 133.56 14.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.196 2.199 . . . . 10.0 106.999 -169.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -144.14 -86.86 0.13 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.783 0.833 . . . . 10.0 110.206 -170.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.473 ' O ' HMD3 ' A' ' 105' ' ' HEC . 3.1 m -81.23 -9.48 59.77 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.735 1.214 . . . . 10.0 111.886 177.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -138.8 173.66 22.48 Favored Glycine 0 CA--C 1.544 1.871 0 C-N-CA 126.51 2.005 . . . . 10.0 110.716 162.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 66.9 Cg_endo -71.64 -144.86 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.08 1 C-N-CA 125.379 4.052 . . . . 10.0 109.741 168.193 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -142.81 150.98 40.66 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 119.87 -1.769 . . . . 10.0 110.452 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.62 70.61 7.39 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 81.98 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 10.0 110.234 172.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.1 -67.78 0.48 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.584 2.516 . . . . 10.0 113.303 -176.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.11 -161.68 0.16 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.817 1.647 . . . . 10.0 111.064 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 60.43 64.37 1.22 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.204 1.801 . . . . 10.0 111.422 -173.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.7 42.58 0.86 Allowed Glycine 0 CA--C 1.532 1.151 0 CA-C-N 113.451 -1.704 . . . . 10.0 113.54 -172.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -150.95 150.5 30.89 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.21 1.404 . . . . 10.0 110.668 -177.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 163.59 18.41 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.909 1.077 . . . . 10.0 113.909 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.5 -16.62 58.61 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.278 1.831 . . . . 10.0 113.822 174.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.36 58.41 1.56 Allowed Glycine 0 CA--C 1.536 1.361 0 O-C-N 120.224 -1.547 . . . . 10.0 112.51 170.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -150.31 110.34 4.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.701 2.0 . . . . 10.0 112.238 -170.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.84 157.3 14.01 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.791 1.636 . . . . 10.0 110.376 165.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -84.81 -126.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 124.684 3.589 . . . . 10.0 109.215 159.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.92 79.78 0.37 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.368 1.461 . . . . 10.0 113.48 177.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.403 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 78.6 t80 -144.73 176.4 9.47 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.352 1.861 . . . . 10.0 110.714 172.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 96.7 m -154.39 100.03 2.25 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.881 -1.762 . . . . 10.0 110.832 171.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.61 167.64 16.07 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.338 2.255 . . . . 10.0 112.008 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.8 p -70.7 130.62 42.23 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.125 0.964 . . . . 10.0 111.051 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -33.2 71.86 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.364 1.616 . . . . 10.0 115.364 -162.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.25 -14.57 60.94 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.207 1.188 . . . . 10.0 114.207 -177.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -64.62 -70.06 0.25 Allowed 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.77 1.168 . . . . 10.0 110.244 169.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.16 -41.9 28.13 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.447 1.099 . . . . 10.0 112.104 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.17 -23.66 67.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.835 1.254 . . . . 10.0 114.002 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -74.01 -24.33 59.55 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.26 0.936 . . . . 10.0 112.677 170.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 65.32 12.62 56.22 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 116.844 1.498 . . . . 10.0 116.844 160.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.17 -12.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 129.221 3.008 . . . . 10.0 118.38 -160.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.0 m 56.73 118.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 128.197 2.599 . . . . 10.0 114.006 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 29.0 m95 -75.4 122.17 23.38 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.107 -0.951 . . . . 10.0 112.543 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -163.94 -177.94 5.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 130.207 3.403 . . . . 10.0 107.663 169.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -46.71 -57.94 4.35 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.956 1.253 . . . . 10.0 112.654 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -57.93 15.89 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 130.093 3.357 . . . . 10.0 116.691 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.8 p -158.15 -43.07 0.06 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.221 1.809 . . . . 10.0 109.976 -175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.82 -33.54 60.08 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.735 1.214 . . . . 10.0 113.102 174.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.6 tpp -65.93 -48.96 69.66 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.803 0.729 . . . . 10.0 109.472 174.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.74 -43.87 97.69 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.634 1.173 . . . . 10.0 109.953 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -58.02 -64.61 0.85 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.224 -0.893 . . . . 10.0 111.719 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -24.4 67.58 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.494 1.497 . . . . 10.0 113.686 -174.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -73.48 -22.87 60.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.745 1.387 . . . . 10.0 114.745 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.98 71.13 2.35 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 120.194 1.361 . . . . 10.0 111.487 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.68 -48.03 0.82 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.225 1.95 . . . . 10.0 111.506 -164.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.7 mtmt -70.28 33.43 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 128.313 2.645 . . . . 10.0 114.097 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -161.91 -39.14 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 127.114 2.165 . . . . 10.0 112.0 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -65.39 -34.21 77.78 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.169 0.44 . . . . 10.0 111.721 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.98 153.25 78.43 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.396 1.078 . . . . 10.0 111.022 171.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.38 93.81 0.75 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.058 3.172 . . . . 10.0 112.757 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.69 49.17 6.25 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.962 0.745 . . . . 10.0 114.962 161.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.1 m -65.39 -19.7 66.06 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.579 1.326 . . . . 10.0 114.579 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 64.87 -45.93 0.34 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.417 2.287 . . . . 10.0 115.653 -176.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.2 ttt 2.7 97.51 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 129.547 3.139 . . . . 10.0 115.393 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . 0.267 9.9 tp -76.12 74.72 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 122.547 1.165 . . . . 10.0 112.237 -178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -162.45 -66.6 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.35 1.86 . . . . 10.0 109.981 170.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.11 -0.56 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 119.927 3.306 . . . . 10.0 119.927 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.17 95.5 0.22 Allowed Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.765 1.621 . . . . 10.0 113.209 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 tp -67.27 159.46 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.904 0.882 . . . . 10.0 112.19 174.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -64.71 -42.03 95.58 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.946 1.298 . . . . 10.0 114.384 -174.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' THR . 3.6 ptpp? -162.97 170.21 18.42 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.585 1.954 . . . . 10.0 109.555 165.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -55.91 -32.1 63.46 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.408 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 12.4 m -56.87 -37.27 71.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.757 1.223 . . . . 10.0 113.235 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -77.19 -15.53 59.46 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.698 1.199 . . . . 10.0 114.147 171.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.477 HH21 HG12 ' A' ' 95' ' ' ILE . 0.0 OUTLIER -76.54 -48.76 18.33 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.237 -1.539 . . . . 10.0 110.866 166.429 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -54.53 -55.47 28.86 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.94 1.296 . . . . 10.0 111.775 172.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -63.69 -35.48 80.7 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.149 0.796 . . . . 10.0 113.149 -172.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.1 mp -62.08 -42.61 99.38 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.834 1.254 . . . . 10.0 112.687 170.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.477 HG12 HH21 ' A' ' 91' ' ' ARG . 21.8 mm -59.57 -50.89 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.592 0.633 . . . . 10.0 109.754 171.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.62 83.57 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.752 0.821 . . . . 10.0 112.045 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -56.6 -57.49 12.13 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.904 1.282 . . . . 10.0 111.635 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 82.3 mt -70.95 -25.88 62.92 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.927 1.239 . . . . 10.0 112.741 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? -61.07 -29.17 69.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.242 1.017 . . . . 10.0 112.637 165.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -76.54 -51.65 11.29 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 125.145 1.378 . . . . 10.0 110.989 163.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 98' ' ' LEU . . . -54.65 -22.51 13.85 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 121.474 1.943 . . . . 10.0 116.11 -174.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.8 0.73 12.24 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 169.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -153.92 -16.82 0.14 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 128.046 2.538 . . . . 10.0 115.499 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.255 1.356 0 C-N-CA 127.703 2.401 . . . . 10.0 111.792 -163.829 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.473 HMD3 ' O ' ' A' ' 28' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.194 0 CA-C-O 118.217 -1.324 . . . . 10.0 113.642 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -134.55 118.0 16.79 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.627 . . . . 10.0 111.036 -139.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.7 p -50.27 -38.45 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.515 1.126 . . . . 10.0 112.658 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -59.78 -38.73 82.67 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.343 1.457 . . . . 10.0 113.724 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -73.98 -30.45 62.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.448 0.699 . . . . 10.0 110.766 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.47 -50.71 11.13 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 26.98 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.701 2.4 . . . . 10.0 115.146 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.01 -28.5 0.06 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.385 1.474 . . . . 10.0 112.693 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.4 tp -70.19 -37.24 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 120.775 1.625 . . . . 10.0 110.925 161.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -55.54 -51.0 68.53 Favored 'General case' 0 C--N 1.347 0.486 0 O-C-N 121.258 -0.901 . . . . 10.0 110.395 168.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 t -66.89 -8.33 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -176.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -96.19 -48.83 5.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.227 1.411 . . . . 10.0 112.169 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -125.07 6.26 7.91 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.668 1.729 . . . . 10.0 115.668 -166.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.4 m -122.61 -44.05 2.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.51 1.924 . . . . 10.0 111.011 172.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.68 -21.59 60.77 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -55.1 -11.61 0.73 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.894 2.078 . . . . 10.0 115.334 169.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 51.8 m -141.84 -30.22 0.59 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.079 1.752 . . . . 10.0 111.566 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.437 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 86.3 m-70 -105.89 -20.43 13.44 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.656 1.354 . . . . 10.0 114.656 -176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.1 p 56.13 12.96 1.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 118.364 2.727 . . . . 10.0 118.364 173.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.402 HG21 ' H ' ' A' ' 32' ' ' LEU . 4.0 t -66.29 165.45 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.273 1.829 . . . . 10.0 112.91 -173.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 87.95 0.15 0.44 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 130.14 3.376 . . . . 10.0 112.905 177.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -151.42 -172.1 4.12 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 128.493 2.717 . . . . 10.0 108.059 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -66.49 68.87 0.16 Allowed Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.221 1.391 . . . . 10.0 112.662 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.9 -171.84 48.31 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 126.095 1.807 . . . . 10.0 114.546 -174.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -163.13 -166.51 1.28 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.86 2.864 . . . . 10.0 109.12 -175.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -152.95 91.84 1.58 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.892 0.877 . . . . 10.0 109.483 -162.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -143.47 2.07 1.24 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.508 1.523 . . . . 10.0 113.146 -165.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m -154.66 -31.21 0.11 Allowed 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.69 -1.257 . . . . 10.0 110.578 164.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.78 163.6 12.17 Favored Glycine 0 CA--C 1.544 1.871 0 N-CA-C 110.951 -0.86 . . . . 10.0 110.951 152.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 40.1 Cg_endo -75.8 0.43 9.23 Favored 'Trans proline' 0 CA--C 1.538 0.683 1 C-N-CA 125.784 4.323 . . . . 10.0 116.571 -175.258 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 64.92 145.34 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.987 2.515 . . . . 10.0 114.056 -163.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' H ' HG21 ' A' ' 20' ' ' VAL . 1.8 mm? -85.26 73.29 10.61 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.225 -0.922 . . . . 10.0 109.493 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -161.93 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.469 0.707 . . . . 10.0 112.271 162.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.21 53.44 0.08 OUTLIER Glycine 0 CA--C 1.54 1.656 0 C-N-CA 127.473 2.463 . . . . 10.0 117.894 -164.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -70.8 177.9 3.37 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 128.033 2.533 . . . . 10.0 111.094 171.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.288 61.9 m-85 63.02 39.35 10.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.578 1.951 . . . . 10.0 112.24 -161.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.37 45.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.302 0 N-CA-C 116.3 1.28 . . . . 10.0 116.3 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.45 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -152.82 -99.45 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.498 1.649 . . . . 10.0 112.917 174.589 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.45 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -178.35 -165.94 0.1 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 131.563 3.945 . . . . 10.0 107.779 174.346 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.3 t -76.56 -140.7 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.446 1.098 . . . . 10.0 110.228 158.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.4 -69.48 3.36 Favored Glycine 0 CA--C 1.528 0.897 0 O-C-N 120.216 -1.553 . . . . 10.0 112.946 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -64.51 133.58 52.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.617 0.767 . . . . 10.0 111.648 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.85 110.75 0.84 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.93 2.092 . . . . 10.0 108.712 163.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.28 77.59 2.03 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.241 2.627 . . . . 10.0 114.498 -162.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.75 52.46 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.234 1.397 . . . . 10.0 114.587 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -64.16 -59.73 4.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.493 1.917 . . . . 10.0 114.347 -171.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m 77.52 127.07 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.165 2.586 . . . . 10.0 112.691 -164.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.17 -179.41 8.12 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.109 2.564 . . . . 10.0 111.061 -167.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -70.17 158.87 35.0 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.469 -0.769 . . . . 10.0 111.264 168.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.76 -41.98 35.7 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.888 1.811 . . . . 10.0 115.888 -176.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.02 -24.58 47.8 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.926 1.824 . . . . 10.0 115.926 -156.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -60.62 -53.4 57.9 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.849 0.86 . . . . 10.0 111.614 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.27 20.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.229 1.412 . . . . 10.0 111.926 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -58.1 -29.27 65.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.317 1.447 . . . . 10.0 113.727 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -72.91 -20.82 61.01 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.483 1.038 . . . . 10.0 113.759 178.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 59.06 11.08 10.51 Favored Glycine 0 CA--C 1.545 1.937 0 N-CA-C 119.217 2.447 . . . . 10.0 119.217 148.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.9 pt -50.33 -101.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 129.402 3.081 . . . . 10.0 115.796 -170.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -155.1 -27.42 0.11 Allowed 'General case' 0 N--CA 1.48 1.073 0 O-C-N 119.928 -1.733 . . . . 10.0 115.105 -173.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.446 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 0.4 OUTLIER 40.15 95.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.294 2.238 . . . . 10.0 113.757 -159.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -163.17 -175.04 4.1 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.267 2.627 . . . . 10.0 109.066 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -44.18 -53.89 6.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.224 2.21 . . . . 10.0 113.124 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.97 19.67 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.303 2.241 . . . . 10.0 116.199 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.3 p -160.05 -45.73 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.364 1.465 . . . . 10.0 110.716 -165.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.74 -22.24 56.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.634 1.174 . . . . 10.0 111.835 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -60.42 3.62 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.571 -0.9 . . . . 10.0 108.571 165.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.2 -37.68 83.86 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 110.538 -0.171 . . . . 10.0 110.538 -176.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -70.43 -51.71 27.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 118.018 -0.991 . . . . 10.0 113.258 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.43 -34.05 76.43 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.356 1.889 . . . . 10.0 113.236 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -72.86 -29.58 63.3 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.101 0.778 . . . . 10.0 113.101 174.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.28 72.43 2.25 Favored Pre-proline 0 CA--C 1.561 1.374 0 N-CA-C 113.695 0.998 . . . . 10.0 113.695 -173.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.39 -50.31 0.73 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.736 2.958 . . . . 10.0 112.887 -165.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.74 -36.11 71.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.64 1.976 . . . . 10.0 112.921 177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -30.29 58.1 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.587 1.555 . . . . 10.0 112.793 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -75.78 -52.92 9.36 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.865 1.061 . . . . 10.0 113.865 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.0 pt -128.93 139.77 36.66 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 118.558 0.617 . . . . 10.0 112.279 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.55 146.89 56.54 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.939 2.426 . . . . 10.0 111.874 -168.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.13 10.84 10.32 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.82 1.2 . . . . 10.0 115.717 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.46 139.22 49.54 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 119.956 1.878 . . . . 10.0 110.4 175.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -84.8 -61.1 1.86 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 117.214 -1.374 . . . . 10.0 112.675 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.1 ttt 8.84 83.29 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 128.719 2.807 . . . . 10.0 114.098 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.7 mt -73.24 74.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.307 1.443 . . . . 10.0 109.911 -171.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -163.15 -52.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.097 0.959 . . . . 10.0 112.911 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 40.15 82.82 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.261 2.225 . . . . 10.0 116.163 172.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.02 105.27 2.86 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.171 0.891 . . . . 10.0 111.781 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.2 tt -62.55 -50.86 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.864 -0.786 . . . . 10.0 112.494 -172.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.0 mttt 161.45 174.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 1 C-N-CA 132.291 4.236 . . . . 10.0 109.299 161.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 87' ' ' LYS . 10.5 mmpt? 43.64 -98.59 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.962 2.505 . . . . 10.0 112.195 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.85 -49.0 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 129.681 3.192 . . . . 10.0 109.519 173.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 m -49.82 -46.66 51.36 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.736 2.014 . . . . 10.0 112.669 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -56.94 -35.97 69.71 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.108 0.963 . . . . 10.0 112.159 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -41.0 63.4 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.512 0.597 . . . . 10.0 111.032 175.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.04 -47.1 78.5 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 118.724 0.693 . . . . 10.0 111.997 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -57.14 -45.86 83.18 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.534 1.534 . . . . 10.0 111.818 174.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.489 HD21 HMB1 ' A' ' 105' ' ' HEC . 1.1 mp -56.02 -47.15 78.36 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 124.455 1.102 . . . . 10.0 113.364 175.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 32.5 mm -62.61 -46.06 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 118.355 -0.831 . . . . 10.0 109.145 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.05 82.52 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.966 0.803 . . . . 10.0 112.576 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.02 -63.19 1.17 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.281 1.032 . . . . 10.0 112.572 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.06 -37.63 80.42 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.787 0.835 . . . . 10.0 112.644 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -59.28 -16.94 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.126 0.97 . . . . 10.0 113.392 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -102.61 -45.04 5.16 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 117.529 -1.224 . . . . 10.0 113.725 160.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.58 62.77 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.57 1.692 . . . . 10.0 115.57 -173.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.8 p -72.37 -10.39 59.72 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.869 -1.144 . . . . 10.0 113.931 171.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -154.05 24.77 0.49 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.997 1.719 . . . . 10.0 111.938 -163.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . 0.253 5.4 pt-20 . . . . . 0 C--O 1.248 1.024 0 C-N-CA 126.387 1.875 . . . . 10.0 115.233 -159.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.489 HMB1 HD21 ' A' ' 94' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 110.433 -1.067 . . . . 10.0 110.433 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -150.31 169.72 20.71 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.351 1.46 . . . . 10.0 110.248 -177.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.7 t -58.11 -57.11 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.845 1.258 . . . . 10.0 109.803 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.464 ' OE2' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -62.85 -39.1 93.35 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.117 1.367 . . . . 10.0 113.995 179.255 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -63.65 -29.79 70.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.236 -0.888 . . . . 10.0 112.345 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -89.83 -43.21 5.17 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 124.92 1.248 . . . . 10.0 112.503 -170.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.464 ' HE2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.544 -0.974 . . . . 10.0 112.606 175.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -35.81 79.59 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.09 -0.957 . . . . 10.0 112.967 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.7 tp -78.2 -33.22 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.728 1.149 . . . . 10.0 110.889 176.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -57.07 -52.9 63.42 Favored 'General case' 0 C--N 1.342 0.263 0 O-C-N 121.224 -0.923 . . . . 10.0 110.437 166.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.4 t -65.8 -9.02 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 O-C-N 121.336 -0.853 . . . . 10.0 113.166 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.96 -37.79 10.05 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.662 1.585 . . . . 10.0 112.047 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptm -124.03 -14.08 7.17 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.817 1.414 . . . . 10.0 114.817 -168.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.5 m -119.86 -39.89 2.8 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.772 1.629 . . . . 10.0 111.725 -172.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.485 ' HA ' ' H ' ' A' ' 19' ' ' THR . . . -56.96 -20.23 22.52 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 168.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.67 -21.05 2.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.692 1.997 . . . . 10.0 113.602 168.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.0 m -143.13 -28.83 0.55 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.555 1.542 . . . . 10.0 114.759 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.46 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 91.3 m-70 -103.49 -55.73 2.34 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.591 1.33 . . . . 10.0 114.591 -169.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.485 ' H ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 m 35.11 84.35 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.593 2.757 . . . . 10.0 114.173 -168.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.63 -34.09 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.361 1.065 . . . . 10.0 112.545 164.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -95.1 154.8 17.0 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.921 0.711 . . . . 10.0 112.921 -156.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.8 mttp 50.98 -120.84 1.69 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.165 1.386 . . . . 10.0 110.485 176.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.13 62.49 3.34 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.549 1.071 . . . . 10.0 112.405 172.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.58 149.05 51.16 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.202 1.382 . . . . 10.0 114.908 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -162.19 105.36 1.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.859 1.664 . . . . 10.0 111.932 -164.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -67.8 70.19 0.13 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.848 2.059 . . . . 10.0 113.429 176.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.13 -38.95 69.14 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.427 1.491 . . . . 10.0 113.973 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.0 m -153.39 -9.69 0.16 Allowed 'General case' 0 N--CA 1.482 1.158 0 O-C-N 120.769 -1.207 . . . . 10.0 113.189 -171.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.46 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -129.15 172.05 19.81 Favored Glycine 0 CA--C 1.539 1.569 0 N-CA-C 109.525 -1.43 . . . . 10.0 109.525 152.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -71.65 163.58 38.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 120.286 2.043 . . . . 10.0 110.033 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -72.03 7.76 1.52 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.825 1.787 . . . . 10.0 115.825 -167.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mp 40.3 73.68 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.219 1.408 . . . . 10.0 111.587 -165.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -53.34 -164.51 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.894 2.878 . . . . 10.0 113.243 173.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.72 58.72 0.05 OUTLIER Glycine 0 CA--C 1.541 1.658 0 O-C-N 120.011 -1.681 . . . . 10.0 113.149 163.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tp -69.76 -38.47 76.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 128.679 2.792 . . . . 10.0 113.832 -161.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -66.21 95.95 0.32 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.457 1.503 . . . . 10.0 110.29 -175.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.72 13.85 9.99 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.225 1.393 . . . . 10.0 114.678 -173.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.6 ptm85 -150.64 -176.61 5.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.413 2.107 . . . . 10.0 114.74 -175.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -74.6 161.75 29.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.973 2.109 . . . . 10.0 113.837 -163.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.57 -34.74 25.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.56 1.944 . . . . 10.0 113.315 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.92 2.58 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 119.908 -1.745 . . . . 10.0 112.696 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.81 -5.01 1.05 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 118.057 2.614 . . . . 10.0 118.057 -168.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.92 113.75 27.86 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 125.807 1.643 . . . . 10.0 114.424 -167.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -79.22 57.25 6.39 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.552 3.501 . . . . 10.0 113.211 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.59 67.2 0.23 Allowed Glycine 0 N--CA 1.471 1.031 0 C-N-CA 124.527 1.061 . . . . 10.0 112.989 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -144.9 177.76 8.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.352 1.461 . . . . 10.0 109.255 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.2 t -152.77 123.85 7.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.271 1.028 . . . . 10.0 109.686 -177.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' HB2' ' HZ3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -157.19 172.48 18.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.492 1.517 . . . . 10.0 112.705 -159.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.4 p -74.81 107.12 6.7 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.541 -0.725 . . . . 10.0 110.902 177.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -75.21 83.35 2.38 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 122.489 1.138 . . . . 10.0 112.877 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -139.27 -46.21 0.46 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.096 1.758 . . . . 10.0 108.924 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -45.5 -67.04 0.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.373 2.269 . . . . 10.0 111.024 161.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.514 ' HZ3' ' HB2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -57.0 -49.33 76.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.265 0.939 . . . . 10.0 111.727 -178.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.69 -17.38 3.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.317 1.847 . . . . 10.0 115.012 173.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.16 60.08 0.29 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.345 0.975 . . . . 10.0 111.002 -169.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.06 -160.39 4.68 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.882 1.706 . . . . 10.0 115.527 173.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.3 pp -169.99 5.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 126.887 2.075 . . . . 10.0 112.698 -150.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.6 m 56.0 118.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.923 2.089 . . . . 10.0 113.645 -163.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -69.53 121.98 18.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.73 -1.231 . . . . 10.0 110.441 168.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -171.03 -179.05 2.63 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.349 1.859 . . . . 10.0 111.439 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -62.06 27.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 131.177 3.791 . . . . 10.0 115.46 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -160.07 9.28 0.1 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.254 2.222 . . . . 10.0 112.089 -167.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 61.2 p -157.71 -26.78 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.911 -1.118 . . . . 10.0 111.767 -165.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.8 -28.41 60.71 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 117.833 -1.079 . . . . 10.0 112.843 164.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -62.66 -54.3 41.5 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.684 1.129 . . . . 10.0 109.217 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 tp10 -64.07 -41.71 97.25 Favored 'General case' 0 N--CA 1.463 0.195 0 O-C-N 123.527 0.517 . . . . 10.0 110.017 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.64 -48.57 74.33 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.644 -0.693 . . . . 10.0 112.34 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -59.31 -53.96 52.3 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.288 1.403 . . . . 10.0 110.174 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.39 -18.63 63.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.883 1.438 . . . . 10.0 114.883 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.19 67.45 2.36 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 123.845 0.858 . . . . 10.0 111.803 -176.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.9 -63.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.576 2.851 . . . . 10.0 113.384 -164.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.56 -20.76 65.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.629 1.571 . . . . 10.0 113.473 -178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.88 -51.36 12.67 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.715 2.006 . . . . 10.0 111.275 168.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -60.35 -44.51 95.49 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.83 0.852 . . . . 10.0 112.767 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.34 133.59 20.65 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 124.005 0.922 . . . . 10.0 110.407 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.17 67.75 8.49 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.902 3.068 . . . . 10.0 113.9 -158.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -179.21 -115.31 0.46 Allowed Glycine 0 CA--C 1.524 0.617 0 C-N-CA 124.919 1.247 . . . . 10.0 110.037 167.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . 0.254 36.9 m 67.85 155.89 0.11 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 128.989 2.915 . . . . 10.0 115.013 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mmtt -140.68 19.64 2.35 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.117 1.767 . . . . 10.0 112.601 -175.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.7 ttt -67.78 79.95 0.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.558 1.543 . . . . 10.0 111.398 166.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 71.7 mt -71.14 78.1 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 124.88 1.272 . . . . 10.0 109.87 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -164.09 -40.55 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.022 2.529 . . . . 10.0 110.501 170.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.98 -128.69 1.31 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.299 1.44 . . . . 10.0 112.945 -167.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.59 162.89 53.49 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-O 122.271 0.928 . . . . 10.0 115.131 -162.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.5 tp -80.83 3.91 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 113.757 1.021 . . . . 10.0 113.757 -168.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 62.4 0.65 0.63 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.571 2.348 . . . . 10.0 115.695 172.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -160.37 -144.97 0.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 129.983 3.313 . . . . 10.0 106.847 -163.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.64 -31.73 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 122.953 2.615 . . . . 10.0 117.888 -176.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -61.8 -34.52 76.06 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 121.604 2.002 . . . . 10.0 110.931 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.4 pm0 -75.31 -4.43 39.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.914 2.485 . . . . 10.0 114.731 170.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.4 tpm_? -72.45 -58.25 3.54 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 120.77 -1.206 . . . . 10.0 109.852 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -75.57 -29.7 59.42 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 117.076 -1.44 . . . . 10.0 114.29 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 9.6 p30 -65.06 -42.19 94.45 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.789 2.086 . . . . 10.0 112.7 177.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -55.54 -48.27 74.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.753 1.621 . . . . 10.0 112.532 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.7 mm -61.6 -48.1 90.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 118.872 -0.585 . . . . 10.0 109.642 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.3 91.07 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.638 0.775 . . . . 10.0 112.099 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -60.71 -61.93 2.23 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.846 1.258 . . . . 10.0 111.745 173.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.58 -39.73 94.64 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 118.131 -0.938 . . . . 10.0 112.029 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -16.14 63.2 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.694 1.133 . . . . 10.0 113.352 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -89.2 -58.43 2.54 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 124.24 1.016 . . . . 10.0 109.524 162.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.31 -19.1 32.18 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 115.776 1.769 . . . . 10.0 115.776 -173.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 p -65.71 -11.27 43.87 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.35 1.46 . . . . 10.0 114.589 167.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.98 -15.5 0.14 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.198 1.799 . . . . 10.0 115.028 -168.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 . . . . . 0 C--O 1.244 0.81 0 C-N-CA 126.389 1.875 . . . . 10.0 111.523 -170.132 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.988 0 CA-C-O 118.953 -0.915 . . . . 10.0 113.456 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.446 ' HB2' ' HE3' ' A' ' 5' ' ' LYS . 4.7 m-20 -135.34 139.96 44.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.651 1.58 . . . . 10.0 110.778 178.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.6 p -62.98 -43.66 99.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 -172.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.0 mp0 -61.74 -53.01 61.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.904 0.882 . . . . 10.0 110.795 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 2' ' ' ASP . 4.3 mtmp? -60.88 -20.88 62.67 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.922 1.082 . . . . 10.0 113.922 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -91.58 -38.03 5.98 Favored Glycine 0 C--N 1.337 0.62 0 CA-C-N 119.129 0.877 . . . . 10.0 112.647 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -28.51 65.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.103 1.452 . . . . 10.0 112.473 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HZ1' ' CD ' ' A' ' 90' ' ' GLU . 1.6 pttm -60.92 -50.69 72.39 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.826 0.739 . . . . 10.0 111.629 172.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.1 tp -67.11 -37.16 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 118.515 0.598 . . . . 10.0 110.864 178.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.8 t80 -55.7 -52.0 65.39 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-N 118.082 0.401 . . . . 10.0 110.541 170.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.42 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.4 t -65.95 -11.67 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -95.34 -32.47 12.94 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.89 1.276 . . . . 10.0 112.638 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -122.12 -56.98 1.8 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.883 1.273 . . . . 10.0 111.333 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 12.6 m -67.1 -51.52 53.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.864 1.666 . . . . 10.0 112.6 -171.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.46 -11.03 39.2 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.91 1.078 . . . . 10.0 113.91 -172.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.57 -56.42 21.52 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.17 1.388 . . . . 10.0 109.531 166.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.3 m -85.25 -37.43 20.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.02 1.328 . . . . 10.0 112.556 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -120.82 44.89 2.37 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 127.079 2.152 . . . . 10.0 112.973 -163.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -57.86 125.19 21.98 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 119.872 -1.768 . . . . 10.0 111.537 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.78 -38.24 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-O 117.248 -1.358 . . . . 10.0 114.518 -168.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -11.84 37.81 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 121.46 1.936 . . . . 10.0 114.605 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -152.02 152.01 31.89 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 128.221 2.608 . . . . 10.0 107.944 167.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.25 -67.08 0.93 Allowed Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.07 1.319 . . . . 10.0 114.504 177.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.02 119.58 1.48 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 124.597 1.094 . . . . 10.0 111.68 -170.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -159.54 166.47 30.75 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.211 1.805 . . . . 10.0 110.233 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -152.7 125.65 8.48 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.523 1.129 . . . . 10.0 112.53 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -144.01 120.0 10.68 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.993 2.117 . . . . 10.0 108.407 176.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.6 m 56.85 -31.41 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.217 1.807 . . . . 10.0 115.56 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.49 159.0 19.99 Favored Glycine 0 CA--C 1.545 1.914 0 CA-C-N 120.941 1.7 . . . . 10.0 112.199 164.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.73 168.87 23.38 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 125.079 3.852 . . . . 10.0 113.537 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.51 123.41 19.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.63 -1.294 . . . . 10.0 108.336 162.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.74 93.27 0.1 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.303 1.041 . . . . 10.0 109.096 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -170.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.261 3.024 . . . . 10.0 113.448 -178.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.89 53.34 0.1 OUTLIER Glycine 0 CA--C 1.541 1.698 0 C-N-CA 126.424 1.964 . . . . 10.0 114.816 172.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mp -68.63 177.58 2.42 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 129.594 3.158 . . . . 10.0 112.931 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 64.18 59.7 1.03 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.232 1.813 . . . . 10.0 110.504 -166.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.17 16.84 0.26 Allowed Glycine 0 CA--C 1.535 1.283 0 N-CA-C 116.725 1.45 . . . . 10.0 116.725 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.0 ptm85 -152.88 168.78 24.64 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.326 2.063 . . . . 10.0 112.969 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.75 173.86 11.16 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.472 1.909 . . . . 10.0 113.554 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 77.6 p -69.65 172.57 7.24 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.583 1.953 . . . . 10.0 111.541 159.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.35 51.24 4.45 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.201 -0.937 . . . . 10.0 114.603 171.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -11.22 2.85 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.601 1.334 . . . . 10.0 114.601 -164.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.62 140.77 92.3 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 123.35 0.66 . . . . 10.0 112.036 -175.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.03 63.38 8.74 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.558 2.838 . . . . 10.0 112.24 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.24 64.54 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.371 0.986 . . . . 10.0 114.978 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -67.32 170.36 7.38 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 118.424 1.112 . . . . 10.0 112.115 170.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.4 t -152.72 138.35 17.81 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.075 -1.015 . . . . 10.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 -96.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.464 1.506 . . . . 10.0 111.378 -154.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.2 p -142.24 136.89 30.29 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.599 1.559 . . . . 10.0 109.74 167.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -74.75 -31.05 61.69 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.087 -0.506 . . . . 10.0 112.339 177.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.26 -29.83 70.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.505 1.922 . . . . 10.0 113.299 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -72.8 -74.77 0.16 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.48 0.712 . . . . 10.0 109.542 160.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.412 ' HZ1' ' CG ' ' A' ' 50' ' ' ASP 0.307 0.0 OUTLIER -60.24 -31.64 70.39 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.324 1.601 . . . . 10.0 115.324 -157.133 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.37 -22.89 65.55 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.876 1.435 . . . . 10.0 114.876 173.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.67 -36.29 83.22 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.582 1.083 . . . . 10.0 110.797 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.75 13.49 69.68 Favored Glycine 0 CA--C 1.533 1.165 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 165.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.4 pt -51.61 140.47 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 125.931 1.692 . . . . 10.0 111.85 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.1 m -76.13 108.53 9.11 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.418 0.628 . . . . 10.0 109.783 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -69.98 114.89 8.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.947 0.899 . . . . 10.0 111.33 173.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -163.85 -174.53 3.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.316 3.046 . . . . 10.0 109.294 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.22 -54.36 44.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.215 -0.928 . . . . 10.0 111.849 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -62.88 20.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.982 2.913 . . . . 10.0 115.467 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.4 p -158.37 -36.84 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.463 1.905 . . . . 10.0 111.228 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mp -73.92 -30.76 62.74 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 121.051 1.75 . . . . 10.0 112.642 166.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.1 ttm -64.27 -52.62 57.76 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.559 0.618 . . . . 10.0 109.487 175.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.65 -38.41 91.01 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.339 0.656 . . . . 10.0 110.647 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -64.21 -61.9 1.96 Allowed 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.451 -0.785 . . . . 10.0 112.323 175.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.0 tp -66.49 -30.11 70.37 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 120.323 1.42 . . . . 10.0 113.42 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -68.93 -24.49 64.29 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 119.01 0.823 . . . . 10.0 112.809 172.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.25 77.94 2.02 Favored Pre-proline 0 CA--C 1.556 1.208 0 N-CA-C 114.609 1.337 . . . . 10.0 114.609 172.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.79 -41.43 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 121.883 1.722 . . . . 10.0 112.143 -166.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.446 ' HE2' ' CB ' ' A' ' 83' ' ' ALA . 33.3 mttm -67.58 23.28 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.318 2.647 . . . . 10.0 114.777 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.4 mttm -161.36 -31.97 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.555 2.342 . . . . 10.0 111.932 -170.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -68.51 -31.63 71.02 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.276 0.944 . . . . 10.0 113.321 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 pt -135.81 151.84 74.82 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.889 1.276 . . . . 10.0 110.808 177.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.98 22.17 0.49 Allowed 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.29 3.326 . . . . 10.0 115.91 -159.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.4 100.47 0.17 Allowed Glycine 0 CA--C 1.524 0.638 0 O-C-N 121.206 -0.934 . . . . 10.0 112.663 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.32 -27.53 2.42 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.066 1.506 . . . . 10.0 115.066 -172.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.63 -70.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 116.566 -1.683 . . . . 10.0 112.831 -170.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.6 ttt 23.3 92.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 129.535 3.134 . . . . 10.0 113.914 -176.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.8 mt -70.31 70.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 125.741 1.616 . . . . 10.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -162.76 -70.16 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.458 1.903 . . . . 10.0 110.445 169.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.446 ' CB ' ' HE2' ' A' ' 72' ' ' LYS . . . 45.51 87.09 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.72 2.408 . . . . 10.0 116.732 171.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.65 93.63 2.26 Favored Glycine 0 C--N 1.341 0.843 0 C-N-CA 124.472 1.034 . . . . 10.0 111.181 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.6 tt -66.54 156.24 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 122.34 1.067 . . . . 10.0 113.166 -175.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -59.98 -20.92 60.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.142 2.177 . . . . 10.0 115.356 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -161.51 133.84 5.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.998 2.119 . . . . 10.0 109.392 -165.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.75 -57.33 13.39 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.113 0.965 . . . . 10.0 112.79 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.4 m -50.72 -43.8 57.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.004 1.321 . . . . 10.0 112.278 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.488 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 60.0 mm-40 -59.41 -34.74 72.84 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.394 1.078 . . . . 10.0 112.734 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.471 HH21 HD12 ' A' ' 95' ' ' ILE . 1.3 ttp-105 -70.49 -34.19 72.09 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.127 1.33 . . . . 10.0 112.545 172.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.35 -46.8 72.32 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 174.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -56.57 -52.12 66.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.602 1.561 . . . . 10.0 113.408 171.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 23.3 tp -53.12 -49.44 66.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.714 1.605 . . . . 10.0 113.521 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.471 HD12 HH21 ' A' ' 91' ' ' ARG . 12.1 mt -62.12 -39.28 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-O 119.176 -0.44 . . . . 10.0 110.685 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.44 87.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.562 0.619 . . . . 10.0 112.6 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -56.22 -56.3 22.62 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 117.841 -1.076 . . . . 10.0 111.281 169.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.4 mt -65.14 -34.46 78.44 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 120.029 1.286 . . . . 10.0 112.37 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -59.42 -25.52 64.39 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 171.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -93.75 -62.06 1.43 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.741 1.616 . . . . 10.0 112.057 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.96 -11.17 12.03 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.803 1.779 . . . . 10.0 115.803 -164.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 43.2 p -81.27 -6.6 59.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -153.56 -10.45 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.187 1.795 . . . . 10.0 114.999 -169.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.249 1.046 0 C-N-CA 127.798 2.439 . . . . 10.0 110.725 -177.413 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 CA-C-O 119.46 -0.633 . . . . 10.0 112.002 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -136.65 132.11 34.56 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.118 0.967 . . . . 10.0 111.159 -157.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.48 -54.96 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 125.428 1.491 . . . . 10.0 111.422 -167.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.22 -27.63 66.53 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 115.565 1.691 . . . . 10.0 115.565 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -64.23 -42.6 96.49 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.337 0.517 . . . . 10.0 109.611 163.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.56 -41.98 49.34 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 124.348 0.975 . . . . 10.0 111.377 -170.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -45.17 -59.62 2.54 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 126.987 2.115 . . . . 10.0 111.287 173.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -71.89 -42.3 66.95 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.314 1.046 . . . . 10.0 112.085 -172.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.84 -37.46 79.93 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 118.767 0.712 . . . . 10.0 111.351 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -56.02 -52.24 64.93 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 119.107 0.867 . . . . 10.0 110.107 167.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.414 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 53.5 t -61.36 -14.33 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -92.52 -38.51 11.89 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.472 1.509 . . . . 10.0 112.169 -177.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -130.23 0.09 4.61 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 115.769 1.766 . . . . 10.0 115.769 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.1 m -131.8 -43.48 0.99 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.241 1.417 . . . . 10.0 112.592 -176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -65.64 -25.52 67.4 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.135 -0.978 . . . . 10.0 112.821 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -1.57 0.24 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.542 2.337 . . . . 10.0 114.791 170.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.3 m -143.16 -33.16 0.45 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.004 2.122 . . . . 10.0 112.468 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -115.25 -10.21 12.13 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.018 1.727 . . . . 10.0 115.271 -174.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 p 57.6 -68.17 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 128.661 2.784 . . . . 10.0 117.487 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.3 t 39.22 -96.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 128.954 2.902 . . . . 10.0 112.33 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -65.74 -17.46 64.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.472 1.109 . . . . 10.0 112.605 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -80.39 59.53 3.49 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.604 -1.31 . . . . 10.0 110.974 166.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.75 -58.78 3.01 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.1 1.81 . . . . 10.0 114.633 173.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.74 116.94 2.07 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 124.369 0.985 . . . . 10.0 113.704 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -163.55 172.83 13.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 128.74 2.816 . . . . 10.0 109.196 177.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -152.74 67.68 0.82 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.875 0.87 . . . . 10.0 110.977 -165.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.7 mtpt -96.05 -78.73 0.46 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.808 1.243 . . . . 10.0 111.884 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.436 ' O ' HMD3 ' A' ' 105' ' ' HEC . 1.3 m -81.11 -25.75 36.73 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.373 0.508 . . . . 10.0 112.373 -175.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -132.8 173.86 20.74 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 125.583 1.563 . . . . 10.0 110.286 162.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.476 ' HD3' ' CE2' ' A' ' 46' ' ' PHE . 84.8 Cg_endo -72.21 161.22 45.17 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.36 2.04 . . . . 10.0 110.609 172.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.96 125.08 23.78 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.985 -1.072 . . . . 10.0 109.711 166.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -77.34 74.76 3.9 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 163.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -170.83 0.14 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 10.0 109.503 158.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -32.45 114.44 0.08 OUTLIER Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.13 0.871 . . . . 10.0 112.421 163.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 tp -136.56 -46.79 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.462 1.505 . . . . 10.0 112.054 -174.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.592 ' HB2' HG21 ' A' ' 102' ' ' THR . 2.5 m-85 -71.0 109.58 5.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.434 0.693 . . . . 10.0 109.953 -168.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.25 4.29 90.25 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 118.661 -1.077 . . . . 10.0 113.865 -174.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mtp85 -81.45 -97.28 0.04 OUTLIER 'General case' 0 C--N 1.347 0.478 0 CA-C-O 116.946 -1.502 . . . . 10.0 109.087 169.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -152.42 -119.95 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 120.578 1.536 . . . . 10.0 110.744 174.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.6 m -148.7 165.85 30.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.468 3.107 . . . . 10.0 106.967 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 68.46 -3.58 5.95 Favored Glycine 0 CA--C 1.529 0.917 0 N-CA-C 118.763 2.265 . . . . 10.0 118.763 156.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.23 125.38 26.5 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.603 1.961 . . . . 10.0 111.236 174.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.71 157.38 16.33 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.88 1.672 . . . . 10.0 108.732 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -83.84 -119.24 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 124.005 3.137 . . . . 10.0 109.897 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.99 74.8 0.95 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.915 1.245 . . . . 10.0 113.084 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.476 ' CE2' ' HD3' ' A' ' 30' ' ' PRO . 51.0 t80 -144.56 107.24 4.43 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.019 1.327 . . . . 10.0 111.791 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.5 m -79.77 95.32 5.96 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.773 1.229 . . . . 10.0 111.539 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.05 173.19 11.32 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.356 0.872 . . . . 10.0 113.356 169.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.4 p -69.31 -5.05 20.66 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 128.66 2.784 . . . . 10.0 115.616 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 t70 47.42 -169.46 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.384 1.874 . . . . 10.0 114.046 -159.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.23 -42.82 0.1 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.374 3.07 . . . . 10.0 115.307 -166.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -61.29 2.72 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.838 1.255 . . . . 10.0 111.079 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -43.23 55.18 Favored 'General case' 0 CA--C 1.523 -0.09 0 C-N-CA 127.315 2.246 . . . . 10.0 112.375 168.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -18.22 65.19 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 115.447 1.647 . . . . 10.0 115.447 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.96 -32.29 61.68 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.093 0.86 . . . . 10.0 111.174 170.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.17 28.43 73.68 Favored Glycine 0 CA--C 1.537 1.466 0 N-CA-C 116.277 1.271 . . . . 10.0 116.277 162.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -7.55 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 127.343 2.257 . . . . 10.0 116.584 -173.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.4 m 57.62 108.47 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.695 2.398 . . . . 10.0 114.384 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -66.62 135.07 53.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.18 1.392 . . . . 10.0 110.624 172.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 -28.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 163.23 -72.5 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 129.875 3.27 . . . . 10.0 107.692 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -44.82 -61.77 1.47 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.548 1.939 . . . . 10.0 111.477 -178.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 2.3 p -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 127.611 2.364 . . . . 10.0 112.22 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -32.92 60.23 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.105 0.962 . . . . 10.0 113.449 177.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 6.8 ttm -62.83 -52.9 61.35 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 170.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -64.97 -38.19 90.15 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.226 1.41 . . . . 10.0 111.025 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -60.83 -64.09 1.08 Allowed 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.208 1.003 . . . . 10.0 110.716 170.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.432 HD11 HMB2 ' A' ' 105' ' ' HEC . 84.0 mt -58.72 -32.15 68.94 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.611 1.096 . . . . 10.0 112.67 -175.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.4 -35.33 69.89 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.669 1.359 . . . . 10.0 114.669 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -162.39 80.49 1.81 Allowed Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 119.811 1.187 . . . . 10.0 111.543 173.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.7 -44.68 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.413 2.076 . . . . 10.0 112.174 -160.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -60.14 -34.78 74.02 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 127.209 2.204 . . . . 10.0 113.359 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -76.3 -41.41 48.71 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 119.061 -0.495 . . . . 10.0 111.489 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -69.88 -39.25 76.4 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.649 1.351 . . . . 10.0 114.649 -171.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 21.0 pt -135.17 144.02 48.25 Favored Pre-proline 0 N--CA 1.473 0.696 0 CA-C-N 118.811 0.732 . . . . 10.0 111.458 172.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -69.3 163.87 36.28 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.192 2.594 . . . . 10.0 111.083 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.15 -22.82 0.16 Allowed Glycine 0 CA--C 1.535 1.323 0 N-CA-C 116.344 1.298 . . . . 10.0 116.344 176.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.73 118.63 5.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 120.053 1.926 . . . . 10.0 109.745 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -87.12 -71.08 0.58 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.871 0.868 . . . . 10.0 110.683 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 66.4 ttp 28.61 101.17 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 129.892 3.277 . . . . 10.0 113.987 -176.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.6 tp -64.2 54.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 128.871 2.868 . . . . 10.0 114.407 -174.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -163.4 -176.08 4.56 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.542 2.337 . . . . 10.0 110.697 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.51 -155.82 0.34 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.867 2.467 . . . . 10.0 109.763 -173.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.68 44.06 0.15 Allowed Glycine 0 CA--C 1.536 1.354 0 C-N-CA 128.193 2.806 . . . . 10.0 117.656 -170.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.442 HG23 ' H ' ' A' ' 86' ' ' LYS 0.368 7.4 tt 42.96 -112.19 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 128.833 2.853 . . . . 10.0 113.036 -177.45 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.442 ' H ' HG23 ' A' ' 85' ' ' ILE . 53.9 tttm -149.7 -69.65 0.2 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.157 1.799 . . . . 10.0 113.259 173.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.474 ' HE3' ' H ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -76.74 148.04 36.96 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.486 1.039 . . . . 10.0 110.684 173.255 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -58.55 -36.84 74.52 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.11 -0.369 . . . . 10.0 111.619 169.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 m -55.94 -53.81 52.3 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 124.774 1.23 . . . . 10.0 110.062 176.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -57.76 -39.4 77.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.832 0.853 . . . . 10.0 111.771 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -59.2 -50.51 73.76 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 118.764 -0.636 . . . . 10.0 111.709 175.109 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -58.19 -52.63 64.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.392 1.077 . . . . 10.0 111.539 172.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -55.81 -47.78 76.56 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 126.841 2.056 . . . . 10.0 111.465 -170.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.56 -43.8 93.48 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.4 mm -65.45 -44.26 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 118.948 -0.549 . . . . 10.0 110.528 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.38 85.74 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.649 0.779 . . . . 10.0 112.163 175.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.403 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 1.1 t80 -57.21 -55.07 39.54 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.061 1.344 . . . . 10.0 111.443 171.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 22.6 mt -63.29 -34.7 78.25 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 118.436 -0.792 . . . . 10.0 112.618 -177.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -59.98 -20.79 59.54 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.941 1.296 . . . . 10.0 113.462 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -92.87 -50.68 5.44 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.73 1.212 . . . . 10.0 112.196 165.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.04 -22.85 63.17 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 120.21 1.368 . . . . 10.0 114.567 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 36' ' ' PHE . 14.6 t -76.55 6.4 5.89 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.586 1.954 . . . . 10.0 114.489 169.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -151.37 -42.35 0.12 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.855 1.662 . . . . 10.0 113.685 -166.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 115.987 -1.959 . . . . 10.0 115.224 -179.184 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.436 HMD3 ' O ' ' A' ' 28' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.608 -1.106 . . . . 10.0 113.51 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -118.12 154.5 32.02 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.776 1.63 . . . . 10.0 112.143 166.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.92 -52.15 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.21 1.404 . . . . 10.0 111.886 171.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -47.36 71.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 124.277 1.031 . . . . 10.0 113.469 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.58 -15.66 58.72 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.961 0.8 . . . . 10.0 112.204 172.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.21 -48.96 3.4 Favored Glycine 0 C--N 1.34 0.773 0 C-N-CA 125.224 1.393 . . . . 10.0 112.318 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.416 ' HB3' ' CD1' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -63.88 -35.12 79.6 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 122.264 -0.55 . . . . 10.0 112.478 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -39.18 90.01 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.441 0.904 . . . . 10.0 113.441 174.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -33.89 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.615 1.098 . . . . 10.0 111.079 175.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -55.98 -52.07 65.49 Favored 'General case' 0 C--N 1.342 0.244 0 O-C-N 121.435 -0.791 . . . . 10.0 110.454 167.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.9 t -63.67 -11.41 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 113.632 0.975 . . . . 10.0 113.632 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -85.32 -48.0 9.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.271 1.028 . . . . 10.0 111.337 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -136.07 4.85 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 116.599 2.074 . . . . 10.0 116.599 -168.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.5 m -116.74 -41.6 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.439 1.496 . . . . 10.0 111.215 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.64 -27.07 57.66 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.538 0.94 . . . . 10.0 113.538 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -55.34 -15.21 2.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.882 2.073 . . . . 10.0 115.571 172.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 69.4 m -142.09 -14.32 0.8 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.237 1.415 . . . . 10.0 112.673 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -128.44 -13.45 4.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.845 1.424 . . . . 10.0 114.845 -178.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.3 t 39.46 11.62 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 120.352 3.464 . . . . 10.0 120.352 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.0 p -63.82 -16.02 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 N-CA-C 117.053 2.242 . . . . 10.0 117.053 -160.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.03 6.83 4.71 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.251 1.387 . . . . 10.0 112.443 169.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -152.02 -173.26 4.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.188 2.995 . . . . 10.0 107.941 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.63 134.18 39.06 Favored Glycine 0 CA--C 1.533 1.168 0 O-C-N 121.057 -1.027 . . . . 10.0 112.113 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.05 54.12 3.83 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.502 1.525 . . . . 10.0 116.888 -168.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 25' ' ' LYS . 1.4 mppt? -62.2 91.28 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.506 1.123 . . . . 10.0 110.566 170.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -69.17 66.14 0.16 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.983 1.313 . . . . 10.0 112.523 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -95.05 116.98 29.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.69 1.596 . . . . 10.0 108.097 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 m 57.68 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 127.428 2.291 . . . . 10.0 116.568 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -134.68 148.46 19.53 Favored Glycine 0 CA--C 1.547 2.065 0 CA-C-N 121.902 2.137 . . . . 10.0 113.724 165.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -82.27 68.08 7.89 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.064 3.176 . . . . 10.0 112.395 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 p30 47.73 -11.46 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.495 1 N-CA-C 122.121 4.119 . . . . 10.0 122.121 157.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . 0.315 5.0 mp 55.28 37.37 28.8 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 128.755 2.822 . . . . 10.0 117.158 -175.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.67 108.22 0.29 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.945 1.698 . . . . 10.0 113.954 164.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.27 35.17 49.42 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 116.187 1.235 . . . . 10.0 116.187 158.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.424 ' CD2' HMA3 ' A' ' 105' ' ' HEC . 6.8 mp -58.78 -175.85 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 126.505 1.922 . . . . 10.0 111.696 168.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 60.39 64.97 1.12 Allowed 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.336 -1.478 . . . . 10.0 112.855 -173.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.59 -35.28 2.51 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.591 2.043 . . . . 10.0 112.886 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.544 HH11 ' HB3' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -66.79 154.41 40.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.335 1.054 . . . . 10.0 110.488 169.469 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -62.87 177.97 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.875 1.67 . . . . 10.0 111.963 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.71 156.17 31.25 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.12 -0.988 . . . . 10.0 109.731 158.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.44 -116.21 4.35 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.249 -0.907 . . . . 10.0 112.926 169.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 54.64 -7.38 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.268 2.227 . . . . 10.0 116.766 -172.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.42 158.59 10.51 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.327 2.651 . . . . 10.0 113.349 176.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.53 -175.25 1.04 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.144 2.562 . . . . 10.0 111.002 161.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.99 28.36 0.07 OUTLIER Glycine 0 CA--C 1.541 1.688 0 C-N-CA 127.492 2.472 . . . . 10.0 118.015 -173.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.27 128.06 34.16 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.917 1.687 . . . . 10.0 109.707 166.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 m -73.46 125.04 27.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.175 0.99 . . . . 10.0 112.489 -174.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.412 ' HB2' ' HZ3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -140.08 178.15 7.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.536 1.934 . . . . 10.0 112.572 -175.705 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.0 p -85.93 106.24 16.98 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.169 0.895 . . . . 10.0 110.856 166.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -56.29 -29.49 61.25 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.863 1.801 . . . . 10.0 115.863 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.82 -54.94 31.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.87 1.268 . . . . 10.0 112.094 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -47.27 -55.98 7.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.746 1.618 . . . . 10.0 111.82 174.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.466 ' HZ1' ' CGD' ' A' ' 105' ' ' HEC . 0.2 OUTLIER -57.0 -57.25 13.35 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.571 0.748 . . . . 10.0 110.924 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -65.6 -22.74 66.7 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.489 0.922 . . . . 10.0 113.489 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -20.99 66.38 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.135 0.88 . . . . 10.0 112.858 171.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.06 11.58 63.89 Favored Glycine 0 CA--C 1.535 1.336 0 N-CA-C 116.076 1.191 . . . . 10.0 116.076 164.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.28 -6.29 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 128.643 2.777 . . . . 10.0 117.236 -171.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 84.9 m 58.38 117.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.65 2.78 . . . . 10.0 115.665 171.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.497 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 21.6 m95 -76.0 120.73 21.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.861 -1.063 . . . . 10.0 112.644 -175.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.37 179.21 5.12 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.262 2.225 . . . . 10.0 110.605 -176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.75 -13.24 62.18 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.248 1.419 . . . . 10.0 114.754 -169.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.02 -58.61 3.18 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.505 1.145 . . . . 10.0 111.406 163.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.6 p -75.19 -37.32 61.25 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.728 1.611 . . . . 10.0 112.882 -165.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.02 -11.71 59.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.965 1.306 . . . . 10.0 113.938 172.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -65.95 0.61 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 106.878 -1.527 . . . . 10.0 106.878 158.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -45.53 70.56 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.431 1.092 . . . . 10.0 111.332 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -66.64 -56.05 12.46 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.463 0.912 . . . . 10.0 113.463 -177.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -27.5 65.62 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 120.584 1.538 . . . . 10.0 112.36 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -66.55 -38.06 86.31 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 120.197 1.362 . . . . 10.0 114.227 169.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -162.81 100.13 1.06 Allowed Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 119.885 1.221 . . . . 10.0 111.672 166.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.435 ' HB2' HG21 ' A' ' 78' ' ' THR . 58.3 Cg_endo -71.69 -46.48 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.271 1.981 . . . . 10.0 111.493 -168.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -70.03 -22.36 63.1 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.224 1.81 . . . . 10.0 113.293 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -72.44 -53.93 10.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.716 0.806 . . . . 10.0 110.43 163.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -58.99 -41.0 86.54 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.42 155.27 64.28 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 124.228 1.011 . . . . 10.0 111.852 170.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.36 150.6 52.78 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.56 2.173 . . . . 10.0 113.193 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.87 -100.44 2.52 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 127.089 2.28 . . . . 10.0 111.208 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.435 HG21 ' HB2' ' A' ' 71' ' ' PRO 0.289 96.9 m 34.65 90.43 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 130.731 3.612 . . . . 10.0 116.058 -176.075 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -73.31 19.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.853 1.427 . . . . 10.0 114.853 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 17.5 ttt -70.29 78.16 0.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.158 -0.964 . . . . 10.0 108.932 164.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 25.9 mm -69.51 78.56 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 125.0 1.32 . . . . 10.0 109.654 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -162.73 -72.42 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.52 1.128 . . . . 10.0 111.935 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -70.6 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.268 2.627 . . . . 10.0 116.439 -169.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.17 86.78 0.11 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 126.621 2.058 . . . . 10.0 113.828 -166.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.406 ' CD1' HD22 ' A' ' 94' ' ' LEU . 21.1 tt -63.28 -53.99 38.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 115.108 1.521 . . . . 10.0 115.108 -163.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 163.58 -169.8 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.013 1 C-N-CA 131.821 4.049 . . . . 10.0 109.138 -175.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.435 ' HD2' ' H ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.64 -70.21 0.11 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.924 2.489 . . . . 10.0 114.207 -162.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.71 -51.5 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.502 1.297 . . . . 10.0 114.502 -173.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -46.87 88.26 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.439 1.018 . . . . 10.0 110.525 -175.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -60.27 -33.71 72.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.937 1.695 . . . . 10.0 112.179 -172.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.9 -43.94 97.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.009 2.124 . . . . 10.0 112.476 172.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.71 -43.44 65.9 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.896 1.278 . . . . 10.0 110.565 174.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -58.24 -44.09 88.13 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.689 1.196 . . . . 10.0 110.376 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.493 HD21 HMB1 ' A' ' 105' ' ' HEC . 1.0 OUTLIER -52.61 -47.63 66.85 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 114.229 1.196 . . . . 10.0 114.229 171.567 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.8 mm -64.94 -47.22 89.1 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.62 82.16 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.648 0.779 . . . . 10.0 112.319 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.416 ' CD1' ' HB3' ' A' ' 7' ' ' LYS . 3.6 t80 -65.01 -63.23 1.16 Allowed 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.611 1.164 . . . . 10.0 112.017 171.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.43 -33.27 75.56 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.262 -0.875 . . . . 10.0 112.419 -170.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.55 -14.48 42.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.642 1.177 . . . . 10.0 113.311 172.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -95.29 -58.95 2.0 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.421 1.089 . . . . 10.0 110.952 161.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.81 -16.63 17.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 116.429 2.011 . . . . 10.0 116.429 -168.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.5 p -74.96 -4.54 38.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.844 1.424 . . . . 10.0 114.844 168.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -153.32 -22.24 0.15 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.062 1.745 . . . . 10.0 114.465 -167.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 C--O 1.249 1.035 0 C-N-CA 126.872 2.069 . . . . 10.0 111.059 -160.933 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.497 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.667 0 CA-C-O 118.924 -0.931 . . . . 10.0 112.326 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.07 140.93 36.22 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.087 0.944 . . . . 10.0 112.816 -149.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.436 HG11 ' HG3' ' A' ' 100' ' ' LYS . 0.1 OUTLIER -55.35 -50.05 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.837 2.055 . . . . 10.0 113.223 178.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mp0 -64.44 -32.94 74.77 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.373 -0.829 . . . . 10.0 111.639 -174.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -76.02 -12.38 60.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.031 1.732 . . . . 10.0 112.842 172.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -90.75 -48.01 3.53 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 124.21 0.91 . . . . 10.0 111.269 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -49.98 -44.34 50.79 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.161 0.98 . . . . 10.0 112.831 174.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.432 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -67.26 -12.86 61.21 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.883 1.673 . . . . 10.0 114.328 -177.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.432 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 8.1 tp -114.78 -28.03 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.689 0.796 . . . . 10.0 112.204 174.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -55.58 -52.91 62.17 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.224 1.01 . . . . 10.0 110.456 163.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.33 -12.8 9.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.936 0.717 . . . . 10.0 112.936 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.25 -70.23 0.72 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.919 1.288 . . . . 10.0 109.43 172.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -80.48 -11.14 59.71 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.228 1.566 . . . . 10.0 115.228 -168.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 m -124.46 -48.13 1.83 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.649 1.179 . . . . 10.0 111.735 -171.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.31 -13.2 57.94 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.658 0.985 . . . . 10.0 113.658 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -55.35 -14.15 1.74 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.858 1.663 . . . . 10.0 114.143 162.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.3 m -142.74 -25.03 0.63 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.803 2.041 . . . . 10.0 113.134 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.431 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 81.9 m-70 -126.74 77.17 1.7 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 127.145 2.178 . . . . 10.0 112.154 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 t -75.17 46.52 0.32 Allowed 'General case' 0 CA--C 1.557 1.249 0 O-C-N 120.182 -1.574 . . . . 10.0 114.494 -175.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.72 -51.46 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.802 1.641 . . . . 10.0 113.218 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -53.42 -45.26 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.719 1.208 . . . . 10.0 111.52 -171.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -86.17 7.24 25.8 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.63 1.572 . . . . 10.0 113.198 -176.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 23.02 78.15 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.535 1.064 . . . . 10.0 114.521 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.75 169.54 48.9 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-N 118.885 1.342 . . . . 10.0 112.462 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -70.82 153.64 42.56 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.364 0.602 . . . . 10.0 111.107 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.65 135.47 54.13 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.609 156.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -144.39 -76.55 0.23 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.611 1.164 . . . . 10.0 110.776 -175.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.1 m -76.35 -55.99 5.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.634 0.774 . . . . 10.0 110.039 169.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.72 167.36 16.32 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 123.835 0.731 . . . . 10.0 111.904 169.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 45.7 Cg_endo -68.3 166.3 25.81 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.27 3.313 . . . . 10.0 110.921 169.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -85.19 139.97 31.26 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.664 -1.235 . . . . 10.0 107.664 164.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.7 74.8 5.22 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.587 -0.894 . . . . 10.0 108.587 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 73.66 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.557 3.143 . . . . 10.0 113.159 -178.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.27 -68.73 0.06 OUTLIER Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.506 2.479 . . . . 10.0 111.443 -168.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.451 ' C ' HH11 ' A' ' 38' ' ' ARG 0.288 6.9 tp 112.06 -122.79 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.483 1 C-N-CA 132.529 4.331 . . . . 10.0 109.322 167.002 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 72.0 m-85 32.72 64.81 0.25 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.731 2.412 . . . . 10.0 116.731 167.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.25 -42.24 1.73 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.915 2.198 . . . . 10.0 115.023 172.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.451 HH11 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -64.62 11.0 0.06 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 120.363 3.468 . . . . 10.0 120.363 -158.567 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.9 mttt 79.03 147.2 0.09 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.527 3.131 . . . . 10.0 113.379 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -71.78 -40.65 69.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.605 1.562 . . . . 10.0 111.949 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.0 56.66 1.43 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 126.223 1.868 . . . . 10.0 113.251 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -129.95 -22.75 2.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 -173.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -51.18 105.13 0.48 Allowed Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 126.067 1.747 . . . . 10.0 113.538 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -79.97 62.32 8.48 Favored 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.11 3.207 . . . . 10.0 114.085 -163.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.13 60.63 0.18 Allowed Glycine 0 N--CA 1.471 1.027 0 C-N-CA 124.891 1.234 . . . . 10.0 112.341 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -143.63 170.75 15.25 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.545 1.538 . . . . 10.0 109.748 -169.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.6 t -152.84 153.6 33.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 122.08 0.943 . . . . 10.0 110.946 175.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -155.26 -105.14 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.737 -1.119 . . . . 10.0 110.369 -150.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 50.3 p -141.78 9.44 1.97 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.352 1.061 . . . . 10.0 112.859 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 48.95 -50.14 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.553 3.141 . . . . 10.0 115.009 -159.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.47 -41.22 9.24 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.725 2.01 . . . . 10.0 113.192 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -48.57 -60.9 2.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.514 1.526 . . . . 10.0 112.843 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -75.35 -33.7 61.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.171 0.988 . . . . 10.0 112.12 179.082 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.71 -32.8 74.34 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.429 1.092 . . . . 10.0 113.488 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -50.58 73.51 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.898 0.772 . . . . 10.0 110.357 172.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.84 128.54 0.55 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 123.46 0.553 . . . . 10.0 113.59 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.411 HD13 ' CE2' ' A' ' 59' ' ' TRP . 0.9 OUTLIER -170.71 13.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 126.952 2.101 . . . . 10.0 112.375 -162.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.6 m 44.92 56.58 5.23 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.303 1.441 . . . . 10.0 114.238 152.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.411 ' CE2' HD13 ' A' ' 57' ' ' ILE . 40.3 m95 -52.43 135.82 32.73 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -163.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 15.2 pttp -177.72 -167.47 0.15 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 130.702 3.601 . . . . 10.0 110.579 -168.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -68.74 32.81 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.301 2.641 . . . . 10.0 116.713 -159.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.21 -57.67 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.392 -1.442 . . . . 10.0 111.784 -169.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.4 p -53.63 -44.54 69.62 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 130.942 3.697 . . . . 10.0 111.479 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.9 mp -65.18 -32.98 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.436 1.016 . . . . 10.0 113.37 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.9 mtm -75.24 -25.99 58.53 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 120.116 1.325 . . . . 10.0 111.84 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -75.52 -47.58 26.3 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 118.929 0.786 . . . . 10.0 111.708 162.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.68 -43.33 89.61 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 114.009 1.114 . . . . 10.0 114.009 -173.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -64.36 -41.35 96.78 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.326 1.421 . . . . 10.0 111.68 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -68.6 -28.76 67.21 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.902 1.075 . . . . 10.0 113.902 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -161.34 86.88 1.66 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.731 1.212 . . . . 10.0 111.276 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.07 -48.17 5.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.355 2.037 . . . . 10.0 113.694 -169.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -69.98 -19.36 63.35 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.177 1.391 . . . . 10.0 113.036 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.38 -47.75 46.97 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.493 1.117 . . . . 10.0 110.191 167.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -71.98 -40.75 68.35 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.643 0.979 . . . . 10.0 113.643 -174.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.0 pt -135.79 126.7 16.98 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.345 1.058 . . . . 10.0 109.324 170.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -70.77 148.84 59.41 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.455 2.103 . . . . 10.0 111.261 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 47.37 66.75 1.76 Allowed Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.066 1.317 . . . . 10.0 113.124 176.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 15.2 t -123.61 23.27 8.89 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.216 1.406 . . . . 10.0 113.918 -169.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt 47.83 -88.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.181 2.192 . . . . 10.0 113.631 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.4 ttt 15.21 90.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 131.019 3.728 . . . . 10.0 113.82 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.515 ' H ' HD12 ' A' ' 81' ' ' ILE . 2.6 mp -74.52 54.89 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 126.733 2.013 . . . . 10.0 110.139 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -163.28 66.63 0.19 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.411 1.885 . . . . 10.0 109.709 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.39 112.19 11.45 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.157 0.983 . . . . 10.0 110.408 172.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.26 175.13 32.99 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.766 1.204 . . . . 10.0 113.612 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -143.92 149.47 17.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.317 -1.364 . . . . 10.0 107.317 157.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -66.83 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.277 1.031 . . . . 10.0 113.185 -166.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -77.05 120.99 22.92 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.037 -1.097 . . . . 10.0 108.037 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -63.66 -16.46 61.04 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.073 1.306 . . . . 10.0 113.999 -174.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 m -55.48 -34.94 65.0 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.948 . . . . 10.0 112.421 163.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.19 -38.63 88.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.97 1.308 . . . . 10.0 111.181 173.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -60.87 -50.71 72.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.626 1.17 . . . . 10.0 110.938 175.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.56 -53.16 61.52 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.459 1.103 . . . . 10.0 111.886 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -56.66 -44.09 81.02 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.315 1.446 . . . . 10.0 110.617 -175.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mp -60.32 -45.65 92.65 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.189 1.181 . . . . 10.0 114.189 175.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mm -61.04 -48.59 88.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.91 73.68 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.76 0.424 . . . . 10.0 111.549 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.402 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 3.1 t80 -51.46 -59.1 4.62 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.792 1.637 . . . . 10.0 112.754 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.402 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 48.1 mt -68.45 -36.08 78.51 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.224 0.92 . . . . 10.0 112.15 -178.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -32.46 74.02 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.654 0.661 . . . . 10.0 112.302 178.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HG3' HG11 ' A' ' 3' ' ' VAL . 3.0 mmmp? -72.8 -52.6 14.3 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.333 1.453 . . . . 10.0 112.242 165.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -54.79 -27.98 45.59 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.898 1.444 . . . . 10.0 114.898 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.6 t -76.49 2.78 12.81 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 115.643 1.719 . . . . 10.0 115.643 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -151.32 -1.84 0.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.026 1.491 . . . . 10.0 115.026 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 127.525 2.33 . . . . 10.0 114.488 175.669 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.491 HMD1 ' O1D' ' A' ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.179 -0.768 . . . . 10.0 111.179 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.53 135.16 49.96 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.423 0.689 . . . . 10.0 112.645 -155.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.28 -50.61 70.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 125.749 1.62 . . . . 10.0 111.438 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.83 -40.1 87.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.681 1.592 . . . . 10.0 114.084 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.79 -26.48 68.37 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.751 0.82 . . . . 10.0 112.514 169.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.54 -52.02 4.64 Favored Glycine 0 C--N 1.335 0.499 0 N-CA-C 110.281 -1.128 . . . . 10.0 110.281 -178.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.23 38.7 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.769 2.027 . . . . 10.0 114.709 176.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -42.16 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.713 2.405 . . . . 10.0 110.988 175.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 tp -74.83 -33.96 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 119.796 1.18 . . . . 10.0 111.426 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -56.25 -51.12 69.29 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-O 121.25 0.548 . . . . 10.0 109.889 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.7 t -65.19 -9.43 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.543 0.737 . . . . 10.0 112.539 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -94.56 -58.59 2.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.436 1.494 . . . . 10.0 111.038 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -116.99 8.74 13.49 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 116.236 1.939 . . . . 10.0 116.236 -168.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.8 m -118.81 -46.55 2.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.074 1.35 . . . . 10.0 110.842 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.02 62.58 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.05 1.13 . . . . 10.0 114.05 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.28 -12.12 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.757 1.223 . . . . 10.0 114.146 165.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 67.8 m -143.22 -17.57 0.65 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.083 1.753 . . . . 10.0 114.091 -176.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -132.51 102.07 5.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.699 2.0 . . . . 10.0 112.731 -175.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -67.15 24.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 128.988 2.915 . . . . 10.0 116.943 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.8 p -64.58 -39.33 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 120.404 -1.435 . . . . 10.0 114.483 -168.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -59.9 -14.45 15.53 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.011 1.724 . . . . 10.0 115.064 -160.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -150.31 13.05 0.75 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.1 2.16 . . . . 10.0 110.83 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.85 169.39 2.83 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.74 1.638 . . . . 10.0 113.92 -168.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 159.3 178.88 33.7 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.907 1.242 . . . . 10.0 112.056 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -68.98 168.3 14.04 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 122.026 0.917 . . . . 10.0 110.886 164.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.523 ' CD2' HD22 ' A' ' 31' ' ' ASN . 12.7 m170 -68.27 164.66 20.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.071 1.749 . . . . 10.0 111.478 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HE2' ' C ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -143.11 -46.66 0.3 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.654 0.613 . . . . 10.0 112.654 -171.048 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.1 m -154.06 -30.75 0.12 Allowed 'General case' 0 N--CA 1.479 0.987 0 O-C-N 121.09 -1.006 . . . . 10.0 110.977 168.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -103.69 -174.28 25.82 Favored Glycine 0 CA--C 1.541 1.71 0 N-CA-C 110.402 -1.079 . . . . 10.0 110.402 150.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -65.92 173.83 6.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.639 2.226 . . . . 10.0 110.267 168.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.532 HD21 ' CD2' ' A' ' 33' ' ' HIS . 13.7 p30 -74.01 0.71 12.8 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.391 1.477 . . . . 10.0 112.87 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.47 28.23 15.16 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.429 2.292 . . . . 10.0 114.77 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.532 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -53.74 157.42 2.31 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.826 1.25 . . . . 10.0 112.613 168.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.23 8.69 3.62 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 127.821 2.629 . . . . 10.0 118.787 149.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.436 ' CD2' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -73.17 -173.86 1.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.603 1.702 . . . . 10.0 114.001 -177.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 60.58 48.39 7.47 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.813 1.645 . . . . 10.0 110.367 -152.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 146.06 -17.38 1.74 Allowed Glycine 0 CA--C 1.545 1.927 0 N-CA-C 117.921 1.928 . . . . 10.0 117.921 176.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.436 ' NH1' ' CD2' ' A' ' 35' ' ' LEU . 16.2 ttp180 -63.58 3.92 0.3 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.708 2.484 . . . . 10.0 117.708 -165.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.279 0.0 OUTLIER 70.58 -0.76 2.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.944 2.497 . . . . 10.0 116.615 -170.185 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.293 13.8 t 52.47 -43.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 129.585 3.154 . . . . 10.0 116.217 -165.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.85 76.23 0.01 OUTLIER Glycine 0 CA--C 1.534 1.221 0 C-N-CA 126.468 1.985 . . . . 10.0 112.828 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -168.1 123.0 0.97 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.327 2.251 . . . . 10.0 111.203 -175.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.92 119.02 0.97 Allowed Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.149 1.379 . . . . 10.0 109.394 169.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 69.5 2.9 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.678 2.919 . . . . 10.0 112.134 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.12 75.59 1.25 Allowed Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.215 1.864 . . . . 10.0 112.962 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -146.56 179.88 7.24 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.442 1.497 . . . . 10.0 109.658 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 94.2 m -154.79 88.76 1.2 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.737 1.215 . . . . 10.0 108.838 171.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.485 1.514 . . . . 10.0 110.87 169.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 52.4 p -75.19 71.46 2.22 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.149 0.98 . . . . 10.0 110.909 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -55.97 -12.87 1.57 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.215 2.206 . . . . 10.0 116.112 -161.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -50.33 -26.65 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.452 -1.405 . . . . 10.0 113.141 165.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.476 ' HB2' HD12 ' A' ' 75' ' ' ILE . 17.2 p30 -78.14 -67.86 0.69 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.345 1.979 . . . . 10.0 116.345 159.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.51 -39.27 48.15 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.134 1.333 . . . . 10.0 113.248 -174.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -19.99 65.5 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.445 1.498 . . . . 10.0 114.043 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -66.92 -27.34 67.41 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.928 1.695 . . . . 10.0 111.648 168.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 68.79 12.13 64.1 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 115.619 1.007 . . . . 10.0 115.619 168.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -53.82 -10.17 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 127.655 2.382 . . . . 10.0 115.882 -174.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 88.8 m 57.38 128.61 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 130.122 3.369 . . . . 10.0 115.511 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -75.76 145.8 40.51 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.18 -0.918 . . . . 10.0 112.973 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 175.33 175.18 0.23 Allowed 'General case' 0 CA--C 1.538 0.487 1 C-N-CA 133.33 4.652 . . . . 10.0 106.035 -179.421 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.79 -30.39 22.83 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.517 1.302 . . . . 10.0 114.517 177.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -75.43 5.65 5.54 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.978 2.214 . . . . 10.0 116.978 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.2 p -160.53 -31.07 0.06 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.968 1.307 . . . . 10.0 111.706 -171.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 -19.67 58.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.5 1.046 . . . . 10.0 112.468 171.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -60.82 3.19 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 162.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -53.4 -45.71 69.41 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 127.741 2.416 . . . . 10.0 110.124 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CE1' HD11 ' A' ' 75' ' ' ILE . 70.6 t80 -73.47 -46.91 45.34 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 117.867 -1.063 . . . . 10.0 113.371 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.24 -39.78 95.6 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.969 1.713 . . . . 10.0 111.699 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -65.16 -32.5 74.22 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.578 1.081 . . . . 10.0 113.411 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.15 77.05 1.82 Allowed Pre-proline 0 CA--C 1.558 1.271 0 CA-C-N 119.858 1.208 . . . . 10.0 111.802 -175.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.14 -54.81 0.35 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.112 1.875 . . . . 10.0 112.905 -160.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -64.58 -23.03 67.13 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.322 1.849 . . . . 10.0 113.596 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -77.21 -47.44 20.22 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.622 1.169 . . . . 10.0 111.758 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.89 -45.0 94.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 178.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 52' ' ' ASN . 6.1 pt -136.65 145.94 53.32 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.838 0.855 . . . . 10.0 111.697 176.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.76 161.04 40.04 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 122.994 2.463 . . . . 10.0 113.266 -168.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.22 -25.16 0.26 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 126.328 1.918 . . . . 10.0 116.84 171.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 12.8 m -36.68 115.63 0.38 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 128.18 2.592 . . . . 10.0 114.674 -165.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -86.44 6.66 29.26 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.088 1.514 . . . . 10.0 115.088 177.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.4 ttt -60.4 92.13 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.625 -0.672 . . . . 10.0 109.416 158.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.2 tt -68.06 -17.84 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 122.7 1.238 . . . . 10.0 113.656 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -75.28 78.45 2.38 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.366 2.266 . . . . 10.0 110.728 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.08 59.79 0.18 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.786 1.634 . . . . 10.0 113.193 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.9 -166.12 29.8 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.456 1.503 . . . . 10.0 113.955 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 tt -142.07 155.64 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.951 1.301 . . . . 10.0 109.439 -171.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -67.37 -78.4 0.06 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.158 1.783 . . . . 10.0 113.793 -153.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -76.43 106.75 8.24 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.51 -12.09 2.45 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 116.556 2.058 . . . . 10.0 116.556 -167.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 m -57.68 -40.28 79.05 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.269 1.428 . . . . 10.0 112.798 161.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.88 -35.27 66.32 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.458 1.503 . . . . 10.0 110.863 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.84 2.58 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.59 1.956 . . . . 10.0 114.312 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.491 ' HA ' ' H ' ' A' ' 95' ' ' ILE . 7.3 pt-20 -157.18 -5.4 0.1 Allowed 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.043 1.337 . . . . 10.0 113.5 -174.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -57.21 -47.67 80.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 140.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.58 -49.47 72.64 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.71 1.604 . . . . 10.0 114.577 170.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.491 ' H ' ' HA ' ' A' ' 92' ' ' GLU . 11.2 mm -60.0 -46.43 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.54 83.83 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.184 0.994 . . . . 10.0 112.423 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -58.7 7.39 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.657 1.183 . . . . 10.0 112.083 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.88 -31.6 72.63 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.038 0.836 . . . . 10.0 112.799 -174.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -64.29 -17.98 64.15 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.483 0.92 . . . . 10.0 113.483 173.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -92.32 -56.17 3.14 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.568 -1.206 . . . . 10.0 110.273 163.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.12 32.96 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.58 1.696 . . . . 10.0 115.58 -172.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.4 t -68.21 -19.01 64.73 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.692 1.368 . . . . 10.0 114.692 168.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.34 -0.78 0.23 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 116.467 2.025 . . . . 10.0 116.467 -166.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 126.8 2.04 . . . . 10.0 110.611 -171.28 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.409 ' CGA' HH22 ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 110.429 -1.068 . . . . 10.0 110.429 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.96 148.01 44.67 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.327 1.851 . . . . 10.0 112.676 -171.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.03 -38.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 121.625 -0.672 . . . . 10.0 111.581 172.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 4.7 mp0 -57.16 -44.67 83.68 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.1 1.148 . . . . 10.0 114.1 173.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -63.84 -33.47 75.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 117.86 0.3 . . . . 10.0 110.639 173.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.03 -41.68 31.64 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.302 1.429 . . . . 10.0 111.178 -172.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' A' ' 4' ' ' GLU . 30.7 pttt -69.21 -36.17 76.97 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 118.297 1.049 . . . . 10.0 111.96 174.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.81 -55.91 28.35 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.637 0.775 . . . . 10.0 111.351 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.537 HG13 HD11 ' A' ' 85' ' ' ILE . 9.8 tp -64.56 -33.24 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.576 0.626 . . . . 10.0 112.564 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 39.1 t80 -57.65 -52.5 65.17 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 119.126 0.876 . . . . 10.0 110.459 169.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -62.21 -13.3 9.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -97.29 -36.16 10.49 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.494 1.518 . . . . 10.0 112.785 -175.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -137.01 3.63 2.68 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 116.373 1.99 . . . . 10.0 116.373 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.401 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.7 m -122.77 -43.02 2.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.208 1.403 . . . . 10.0 111.839 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.5 4.9 2.06 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.667 1.358 . . . . 10.0 114.667 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -38.46 14.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.511 1.524 . . . . 10.0 111.932 172.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 m -88.61 -38.04 15.15 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.487 2.315 . . . . 10.0 113.751 168.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.425 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.6 m-70 -114.66 -172.59 2.14 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 129.137 2.975 . . . . 10.0 111.917 -175.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.4 m -166.41 153.1 9.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.68 1.992 . . . . 10.0 108.163 157.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.8 p -156.65 -35.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 113.562 0.949 . . . . 10.0 113.562 169.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -60.33 -4.13 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 130.675 3.59 . . . . 10.0 115.96 -168.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -151.17 7.35 0.52 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.68 2.792 . . . . 10.0 111.662 -170.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.3 160.36 3.08 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 125.536 1.541 . . . . 10.0 111.943 -161.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 165.31 168.74 27.95 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.83 -1.394 . . . . 10.0 114.125 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -77.13 -152.78 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.935 2.094 . . . . 10.0 111.627 170.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -151.11 136.89 18.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.803 2.041 . . . . 10.0 109.198 -173.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 0.7 OUTLIER -143.57 -25.86 0.57 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.691 0.796 . . . . 10.0 112.91 -160.744 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.5 m -152.86 -21.27 0.16 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.788 -1.195 . . . . 10.0 111.852 170.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.425 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -128.18 172.57 19.16 Favored Glycine 0 CA--C 1.544 1.887 0 C-N-CA 124.488 1.042 . . . . 10.0 110.964 150.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.21 166.02 22.51 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 124.392 3.395 . . . . 10.0 112.416 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.98 137.67 57.88 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.07 -1.019 . . . . 10.0 109.196 159.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.83 60.98 2.38 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.349 1.431 . . . . 10.0 111.981 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.18 87.65 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 130.263 3.425 . . . . 10.0 113.568 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.36 43.04 65.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.953 1.74 . . . . 10.0 114.663 169.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.634 ' CD2' HMA3 ' A' ' 105' ' ' HEC . 6.4 mp -72.4 149.6 44.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 117.849 0.825 . . . . 10.0 110.577 173.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 75.52 76.41 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.017 2.527 . . . . 10.0 111.609 -161.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.54 29.97 0.23 Allowed Glycine 0 CA--C 1.536 1.361 0 N-CA-C 117.353 1.701 . . . . 10.0 117.353 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.477 ' HG3' ' H ' ' A' ' 39' ' ' LYS . 13.0 ptt85 -152.53 -84.17 0.08 Allowed 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 120.748 2.274 . . . . 10.0 115.787 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 16.7 pttp -168.28 -176.38 2.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.697 2.799 . . . . 10.0 109.943 -177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -67.15 -132.72 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.718 2.007 . . . . 10.0 111.873 162.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -18.17 115.96 0.01 OUTLIER Glycine 0 CA--C 1.537 1.413 1 C-N-CA 130.708 4.004 . . . . 10.0 117.809 -178.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -152.23 3.52 0.37 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 117.971 2.582 . . . . 10.0 117.971 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 155.0 88.64 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 121.299 1.863 . . . . 10.0 111.874 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.29 74.04 3.16 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.243 2.628 . . . . 10.0 109.637 170.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.48 -73.22 1.63 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.03 1.3 . . . . 10.0 111.624 -170.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 t80 43.6 -143.73 0.12 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.632 1.173 . . . . 10.0 110.102 -164.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.8 m -164.5 108.76 0.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.809 2.044 . . . . 10.0 108.096 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -152.8 176.53 11.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.151 1.38 . . . . 10.0 112.211 -172.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.4 p -80.35 109.78 15.17 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.021 0.915 . . . . 10.0 111.99 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -55.05 -22.41 15.79 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.743 0.817 . . . . 10.0 112.821 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -48.72 -43.04 36.98 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.495 1.118 . . . . 10.0 113.445 170.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.416 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 49.9 t-20 -76.58 -38.81 54.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.751 1.221 . . . . 10.0 112.673 172.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 52' ' ' ASN . 6.8 mmpt? -74.93 -52.11 12.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.819 0.847 . . . . 10.0 110.827 -172.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.97 -21.04 66.39 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.62 1.568 . . . . 10.0 113.466 173.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -28.84 62.85 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.426 1.012 . . . . 10.0 112.815 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.04 4.46 72.48 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 123.878 0.751 . . . . 10.0 114.907 168.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 pp -61.26 178.23 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 10.0 111.313 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.0 m -148.77 108.81 4.08 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 123.256 1.503 . . . . 10.0 111.195 -163.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.496 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 16.5 m95 -54.48 116.37 2.62 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.708 2.003 . . . . 10.0 109.24 169.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 -44.98 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.187 1.395 . . . . 10.0 113.07 -168.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -170.03 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.683 1.993 . . . . 10.0 107.32 162.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -47.34 -54.85 10.04 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.353 2.661 . . . . 10.0 112.399 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -52.72 60.83 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 128.371 2.668 . . . . 10.0 111.962 -176.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.06 -28.34 61.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.919 0.888 . . . . 10.0 112.302 -177.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.87 -55.08 33.47 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.562 0.745 . . . . 10.0 109.957 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.54 -43.79 98.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.458 1.103 . . . . 10.0 110.433 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.8 t80 -66.41 -46.58 76.09 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.038 0.935 . . . . 10.0 112.053 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 -37.25 83.23 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.77 1.623 . . . . 10.0 112.698 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.64 -36.76 84.89 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.036 -0.983 . . . . 10.0 113.063 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -163.45 106.19 0.97 Allowed Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 119.685 1.129 . . . . 10.0 111.873 160.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.43 -48.76 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.481 2.121 . . . . 10.0 110.685 -171.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -37.9 77.2 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.177 1.391 . . . . 10.0 112.475 179.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -61.6 -54.54 41.57 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.69 1.196 . . . . 10.0 110.63 168.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -64.43 -45.25 88.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.918 1.081 . . . . 10.0 113.918 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 pt -136.0 95.45 13.62 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 123.992 0.917 . . . . 10.0 110.548 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.01 76.69 2.05 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 125.035 3.824 . . . . 10.0 113.84 -163.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.51 -25.5 0.03 OUTLIER Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.222 1.868 . . . . 10.0 112.061 165.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.3 t -40.02 116.91 0.7 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.864 2.066 . . . . 10.0 113.975 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -83.18 16.0 2.62 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.148 0.795 . . . . 10.0 113.148 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.8 ttt -67.16 79.1 0.14 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.845 1.307 . . . . 10.0 111.344 171.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tp -72.99 87.07 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 125.307 1.443 . . . . 10.0 111.714 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -161.49 -51.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 118.01 -0.995 . . . . 10.0 113.547 175.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.02 92.96 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.137 2.175 . . . . 10.0 115.871 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.22 -178.86 36.05 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.638 1.113 . . . . 10.0 111.436 -169.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.587 HD12 HBB1 ' A' ' 105' ' ' HEC . 13.5 tt -155.55 82.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.201 1.0 . . . . 10.0 110.35 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 59.78 -54.18 0.07 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 128.065 2.546 . . . . 10.0 116.157 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.24 166.53 25.33 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.021 2.529 . . . . 10.0 110.417 -174.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -53.95 -46.23 71.51 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.189 0.995 . . . . 10.0 113.083 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 17.1 m -68.34 -34.32 75.88 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.669 -0.644 . . . . 10.0 111.896 -175.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -76.86 -10.5 59.41 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.372 1.069 . . . . 10.0 113.445 171.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -35.22 35.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.098 -1.626 . . . . 10.0 114.436 155.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -62.33 -57.14 12.45 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.153 -0.967 . . . . 10.0 111.333 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 58.5 p30 -54.92 -40.65 70.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.725 1.21 . . . . 10.0 112.804 -175.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 85' ' ' ILE . 14.9 tp -60.94 -53.88 51.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.912 2.485 . . . . 10.0 112.996 177.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.02 -44.92 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.185 0.994 . . . . 10.0 108.872 174.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.02 -49.97 75.59 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.661 0.385 . . . . 10.0 111.369 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.8 -61.75 2.1 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.267 1.427 . . . . 10.0 112.068 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.2 mt -59.65 -38.12 80.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.66 1.118 . . . . 10.0 111.815 -176.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -64.76 -24.45 67.56 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.277 1.031 . . . . 10.0 113.596 176.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.512 ' HA ' ' HE2' ' A' ' 100' ' ' LYS . 8.5 mmpt? -87.37 -40.33 14.52 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.847 -1.073 . . . . 10.0 112.239 166.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.68 -22.76 65.6 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.379 1.251 . . . . 10.0 114.379 -179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t -85.73 9.35 16.67 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 169.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -151.58 21.09 0.72 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.454 2.302 . . . . 10.0 111.88 -166.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.817 1.647 . . . . 10.0 111.217 -174.904 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.634 HMA3 ' CD2' ' A' ' 35' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -81.99 -177.81 6.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.282 0.633 . . . . 10.0 109.493 160.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.03 -34.14 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 120.672 -1.268 . . . . 10.0 111.041 145.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -71.55 -38.75 70.96 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 127.937 2.495 . . . . 10.0 113.557 -157.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 3.6 mmpt? -63.6 -31.33 72.47 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 173.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.19 -54.04 9.65 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 127.254 2.359 . . . . 10.0 110.29 -173.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -44.91 85.4 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.098 0.777 . . . . 10.0 113.098 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -26.97 60.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.93 1.455 . . . . 10.0 114.93 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -81.39 -32.49 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.669 1.577 . . . . 10.0 111.67 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.41 -51.33 69.87 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 121.677 -0.639 . . . . 10.0 110.219 170.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.99 -12.01 8.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -83.54 -61.3 1.87 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.232 1.013 . . . . 10.0 110.855 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -102.64 -38.25 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.599 1.16 . . . . 10.0 112.457 -170.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.7 m -83.08 -55.17 4.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.128 1.371 . . . . 10.0 111.902 -172.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.61 -15.74 42.03 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -172.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -59.6 -54.52 45.47 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 129.378 3.071 . . . . 10.0 111.898 167.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.8 m -87.5 -21.22 25.61 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.117 1.525 . . . . 10.0 115.117 169.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -134.7 57.64 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.966 1.706 . . . . 10.0 111.991 -167.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.83 120.29 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.72 -1.238 . . . . 10.0 110.827 -174.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.48 -58.39 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 127.068 2.147 . . . . 10.0 108.792 -177.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 -62.31 9.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.187 2.995 . . . . 10.0 114.376 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -151.86 17.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.16 1.784 . . . . 10.0 112.75 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.33 142.86 9.1 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.847 1.689 . . . . 10.0 111.444 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.78 129.51 9.18 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.702 1.144 . . . . 10.0 113.15 -172.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -164.19 -179.21 5.99 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 127.415 2.286 . . . . 10.0 109.258 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.412 ' CD2' HD22 ' A' ' 31' ' ' ASN . 6.9 m170 -149.52 122.17 8.61 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.95 1.3 . . . . 10.0 107.545 -168.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.01 109.58 0.9 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.23 1.412 . . . . 10.0 109.713 -173.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 m 57.09 -43.35 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.902 2.081 . . . . 10.0 114.144 -161.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.5 166.81 12.44 Favored Glycine 0 CA--C 1.543 1.826 0 CA-C-N 120.191 1.36 . . . . 10.0 113.7 169.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.79 173.58 14.18 Favored 'Trans proline' 0 CA--C 1.541 0.836 1 C-N-CA 125.326 4.017 . . . . 10.0 111.097 167.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.511 HD21 ' CD2' ' A' ' 33' ' ' HIS . 5.9 p30 -77.58 -172.48 2.58 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.222 -0.924 . . . . 10.0 108.745 158.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.1 mt -139.37 51.98 1.75 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 122.798 1.285 . . . . 10.0 111.866 -175.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.511 ' CD2' HD21 ' A' ' 31' ' ' ASN . 0.0 OUTLIER -54.22 134.78 44.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 128.866 2.866 . . . . 10.0 113.165 162.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 54.0 8.38 1.01 Allowed Glycine 0 CA--C 1.54 1.616 0 N-CA-C 118.883 2.313 . . . . 10.0 118.883 160.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -51.55 167.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.784 1.634 . . . . 10.0 111.027 170.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 61.99 36.31 15.64 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.765 1.226 . . . . 10.0 112.554 -169.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 168.4 -42.82 0.23 Allowed Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.565 1.555 . . . . 10.0 110.894 -175.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 41.6 mtp85 -80.81 159.65 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 122.442 1.115 . . . . 10.0 112.067 167.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -70.71 173.91 6.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.682 1.993 . . . . 10.0 110.998 168.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -67.74 168.76 10.77 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.327 1.851 . . . . 10.0 111.334 157.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 53' ' ' LYS . . . 94.08 14.69 51.01 Favored Glycine 0 N--CA 1.471 0.998 0 N-CA-C 117.657 1.823 . . . . 10.0 117.657 160.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.86 -40.52 11.14 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.952 2.101 . . . . 10.0 115.269 -158.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.63 111.17 2.81 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.13 1.372 . . . . 10.0 114.228 -164.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 131.01 18.79 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.417 2.078 . . . . 10.0 112.129 -174.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.01 1.8 69.49 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.91 0.724 . . . . 10.0 114.91 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -73.2 179.27 3.96 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 118.433 1.117 . . . . 10.0 111.052 167.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 98.7 m -154.18 89.02 1.26 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 119.517 -1.99 . . . . 10.0 109.631 176.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.35 173.61 10.8 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 128.508 2.723 . . . . 10.0 112.277 172.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.8 p -71.21 143.87 50.31 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.423 -0.798 . . . . 10.0 110.508 163.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -76.23 65.14 2.13 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.648 -1.283 . . . . 10.0 111.154 166.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -138.96 -59.35 0.6 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.203 1.001 . . . . 10.0 110.474 178.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -54.88 -70.1 0.11 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.919 1.687 . . . . 10.0 111.231 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HB3' ' HA2' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -63.68 -13.13 40.07 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 130.566 3.547 . . . . 10.0 115.309 171.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.29 -56.27 7.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.178 -0.951 . . . . 10.0 111.485 160.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -56.3 -27.95 57.2 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.385 1.874 . . . . 10.0 115.448 -170.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.97 7.09 61.54 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.967 1.147 . . . . 10.0 115.967 168.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -56.93 5.96 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 129.463 3.105 . . . . 10.0 117.155 -171.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 86.6 m 50.59 87.8 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.39 2.676 . . . . 10.0 113.627 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.499 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 3.5 m95 -54.45 125.17 18.48 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.601 2.361 . . . . 10.0 114.987 -171.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -164.66 179.17 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.386 2.674 . . . . 10.0 109.343 -173.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -58.01 -39.3 77.96 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.173 -0.954 . . . . 10.0 112.784 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.89 10.28 0.22 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.444 1.898 . . . . 10.0 115.251 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.2 p -158.21 -33.13 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.757 1.223 . . . . 10.0 111.464 -166.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.13 -29.35 63.98 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 120.469 1.486 . . . . 10.0 112.508 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 73.9 mtm -71.52 -40.1 70.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.251 0.932 . . . . 10.0 111.844 175.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -50.48 72.02 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 167.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.5 -44.73 86.12 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 113.361 0.874 . . . . 10.0 113.361 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.548 ' HB2' HH11 ' A' ' 91' ' ' ARG . 2.7 mm? -73.38 -22.59 60.23 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 121.047 1.749 . . . . 10.0 113.715 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -85.75 -23.85 27.13 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.26 1.208 . . . . 10.0 114.26 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.64 65.56 1.97 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.942 1.297 . . . . 10.0 111.445 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -62.05 -51.55 3.61 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.993 2.462 . . . . 10.0 113.267 -164.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -70.72 -20.8 62.62 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.165 1.786 . . . . 10.0 112.734 -173.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -76.28 -54.39 6.85 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.376 1.47 . . . . 10.0 111.148 163.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -56.87 -45.8 82.24 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.191 0.597 . . . . 10.0 112.335 -175.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.2 pt -133.44 111.91 12.83 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.632 1.173 . . . . 10.0 109.663 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.91 161.11 40.91 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.789 1.66 . . . . 10.0 110.306 175.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.36 5.8 82.58 Favored Glycine 0 CA--C 1.536 1.373 0 CA-C-O 118.648 -1.085 . . . . 10.0 114.769 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m -93.79 122.22 36.04 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.526 1.663 . . . . 10.0 110.769 165.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.26 -10.19 55.05 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.598 1.332 . . . . 10.0 114.598 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttt -21.65 97.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.855 2.862 . . . . 10.0 114.853 -172.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 81' ' ' ILE . 3.8 mp -80.09 69.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 125.652 1.581 . . . . 10.0 109.93 -172.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -164.23 -37.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.069 1.747 . . . . 10.0 111.662 170.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.31 -8.7 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 120.8 3.63 . . . . 10.0 120.8 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.09 118.94 0.75 Allowed Glycine 0 CA--C 1.53 1.003 0 CA-C-N 121.185 1.812 . . . . 10.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.0 tt -66.78 -1.71 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 115.332 1.604 . . . . 10.0 115.332 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.0 tttt 70.34 178.01 0.26 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.09 1.756 . . . . 10.0 111.302 -177.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.42 ' HE2' ' OE2' ' A' ' 90' ' ' GLU . 17.8 mtmm 34.26 -105.3 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 127.435 2.294 . . . . 10.0 112.931 -172.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -178.86 -42.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 CA-C-N 120.449 1.477 . . . . 10.0 114.036 171.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.1 m -54.06 -34.63 60.58 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.604 1.162 . . . . 10.0 111.785 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.42 ' OE2' ' HE2' ' A' ' 87' ' ' LYS . 50.2 mp0 -51.75 -41.5 61.64 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.205 2.202 . . . . 10.0 111.891 172.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.548 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -69.17 -49.0 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.357 1.463 . . . . 10.0 110.829 -178.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -68.39 -32.97 73.41 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.533 1.06 . . . . 10.0 112.503 175.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -44.67 96.7 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.37 -0.832 . . . . 10.0 111.439 169.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp -58.53 -35.79 72.85 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.023 1.119 . . . . 10.0 114.023 171.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.51 -53.14 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.88 0.764 . . . . 10.0 109.17 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.47 -49.42 77.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.871 0.468 . . . . 10.0 111.72 178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.22 -50.88 68.28 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.148 1.379 . . . . 10.0 112.662 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.78 -32.56 65.69 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.861 1.664 . . . . 10.0 112.31 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.07 -38.83 80.36 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.132 0.878 . . . . 10.0 111.618 170.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -65.41 -70.91 0.21 Allowed 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 117.282 -1.342 . . . . 10.0 111.635 163.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.41 -17.57 13.54 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 116.146 1.906 . . . . 10.0 116.146 -166.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 28.4 p -76.23 -0.45 22.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.437 1.495 . . . . 10.0 114.131 167.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.52 -19.89 0.17 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.925 2.49 . . . . 10.0 114.944 -178.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.227 2.611 . . . . 10.0 110.901 -171.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.499 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.77 0 CA-C-O 119.03 -0.872 . . . . 10.0 111.696 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -129.98 147.33 51.72 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.524 0.935 . . . . 10.0 113.524 -150.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.1 -53.77 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.324 1.45 . . . . 10.0 111.615 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.02 -50.2 74.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.893 1.677 . . . . 10.0 113.496 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.96 -37.08 42.3 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 124.099 0.96 . . . . 10.0 112.082 167.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.28 -52.93 8.1 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 109.619 -1.392 . . . . 10.0 109.619 -174.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -58.09 -47.12 84.18 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 118.974 1.387 . . . . 10.0 112.31 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -27.0 65.26 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 tp -90.65 -28.82 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.58 1.082 . . . . 10.0 112.551 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.48 -53.02 62.41 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.597 0.759 . . . . 10.0 109.771 166.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.43 -10.63 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -84.99 -57.68 3.0 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.723 1.209 . . . . 10.0 110.895 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -130.41 13.22 5.52 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.268 1.581 . . . . 10.0 115.268 -168.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.1 m -120.57 -45.29 2.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.906 1.283 . . . . 10.0 111.548 170.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.42 -28.79 70.04 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 114.201 1.186 . . . . 10.0 114.201 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -4.25 3.22 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.709 1.604 . . . . 10.0 114.282 171.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -143.56 6.69 1.46 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.168 2.187 . . . . 10.0 112.69 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -158.47 102.28 1.72 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.746 1.619 . . . . 10.0 108.903 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 p -52.6 -47.83 66.67 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.087 1.884 . . . . 10.0 116.087 -169.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.411 HG22 ' HB2' ' A' ' 32' ' ' LEU . 5.6 t 34.12 -82.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 130.134 3.374 . . . . 10.0 115.857 170.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.27 2.22 0.89 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.081 2.152 . . . . 10.0 113.272 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -151.16 134.31 15.99 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 128.839 2.856 . . . . 10.0 107.87 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.73 74.08 1.82 Allowed Glycine 0 CA--C 1.531 1.063 0 C-N-CA 123.993 0.806 . . . . 10.0 113.574 -172.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.54 159.54 23.45 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-N 117.747 0.774 . . . . 10.0 114.792 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 61.91 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 129.489 3.115 . . . . 10.0 115.768 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.4 m80 70.33 -63.99 0.38 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.545 2.738 . . . . 10.0 113.022 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 50.23 103.37 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 129.236 3.014 . . . . 10.0 113.497 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m 58.3 -25.63 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 128.46 2.704 . . . . 10.0 117.203 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.68 148.76 20.03 Favored Glycine 0 CA--C 1.538 1.496 0 CA-C-N 120.97 1.713 . . . . 10.0 111.787 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -78.34 61.71 7.92 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.019 3.146 . . . . 10.0 114.801 -160.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 49.11 0.81 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 120.536 3.532 . . . . 10.0 120.536 165.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.411 ' HB2' HG22 ' A' ' 20' ' ' VAL . 1.5 mm? 42.56 60.41 2.4 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.592 1.957 . . . . 10.0 110.798 -171.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.79 168.51 0.28 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.92 -1.036 . . . . 10.0 109.678 157.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -23.27 110.57 0.01 OUTLIER Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.645 1.593 . . . . 10.0 113.519 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.95 -74.59 0.61 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.799 1.24 . . . . 10.0 110.036 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -64.88 84.99 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.506 1.922 . . . . 10.0 111.34 -171.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.71 -4.42 2.45 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.756 1.645 . . . . 10.0 114.696 -172.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -152.74 -172.23 4.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.365 1.466 . . . . 10.0 111.2 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -85.62 -173.71 4.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.362 1.245 . . . . 10.0 114.362 -175.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -60.78 -151.84 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.004 1.722 . . . . 10.0 111.992 158.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 95.07 -67.33 1.23 Allowed Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.662 -1.899 . . . . 10.0 116.314 167.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -69.25 25.33 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 118.954 2.946 . . . . 10.0 118.954 -152.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.24 113.59 8.41 Favored Pre-proline 0 CA--C 1.554 1.109 0 CA-C-N 121.562 1.983 . . . . 10.0 112.755 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.56 70.78 6.73 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 123.34 2.693 . . . . 10.0 112.832 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.86 69.76 1.16 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.556 1.074 . . . . 10.0 112.874 172.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -151.74 176.65 11.19 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.064 1.746 . . . . 10.0 109.04 174.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -152.19 115.6 4.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.908 2.083 . . . . 10.0 107.885 -165.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -61.23 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.195 1.398 . . . . 10.0 111.103 -161.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.7 t -162.57 165.73 25.6 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 128.802 2.841 . . . . 10.0 108.874 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.08 -67.5 0.6 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.597 1.159 . . . . 10.0 110.741 157.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.21 -65.07 0.21 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 129.111 2.965 . . . . 10.0 115.333 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.558 HD22 ' CGD' ' A' ' 105' ' ' HEC . 16.1 t30 -51.87 -70.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.07 0.85 . . . . 10.0 111.57 -176.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -74.46 -16.6 60.85 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.853 -165.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -65.85 -57.66 7.4 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.852 1.261 . . . . 10.0 113.775 157.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -14.93 48.02 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 115.673 1.731 . . . . 10.0 115.673 -163.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.55 11.06 85.66 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 117.915 1.926 . . . . 10.0 117.915 151.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.72 156.16 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 119.819 1.81 . . . . 10.0 113.458 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 m -68.02 108.87 3.24 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.46 1.504 . . . . 10.0 110.716 176.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.414 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 0.0 OUTLIER -76.76 112.38 13.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.82 -0.55 . . . . 10.0 111.555 172.186 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -162.17 -162.57 0.84 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.03 1.332 . . . . 10.0 109.695 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' HD12 ' A' ' 95' ' ' ILE . 40.3 tt0 -41.84 -66.33 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 131.091 3.756 . . . . 10.0 113.21 -174.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -58.36 -54.62 44.9 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.247 1.419 . . . . 10.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 78.7 p -67.84 -35.9 79.39 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.039 0.936 . . . . 10.0 112.973 -173.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.18 -27.51 59.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 119.832 1.196 . . . . 10.0 113.504 173.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 69.6 mtm -65.91 -52.13 52.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 119.446 1.021 . . . . 10.0 109.406 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.9 -44.38 91.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.136 0.493 . . . . 10.0 110.477 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -63.89 -55.72 20.63 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' HH11 ' A' ' 91' ' ' ARG . 0.2 OUTLIER -75.22 -10.78 59.78 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 121.066 1.757 . . . . 10.0 113.348 -177.729 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -85.37 -25.42 27.08 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.798 1.181 . . . . 10.0 113.978 167.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -162.33 98.37 1.14 Allowed Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 119.618 1.099 . . . . 10.0 112.974 157.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.35 -47.68 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.765 1.643 . . . . 10.0 112.042 -167.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -64.89 -32.01 73.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.456 1.502 . . . . 10.0 113.027 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -75.78 -39.13 57.53 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-O 118.108 -0.949 . . . . 10.0 112.728 168.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -68.8 -40.18 79.72 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.517 0.932 . . . . 10.0 113.517 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.02 135.25 25.53 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.803 0.841 . . . . 10.0 110.998 174.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -80.18 50.54 3.57 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.088 3.192 . . . . 10.0 114.544 -157.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.48 61.77 0.01 OUTLIER Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.422 -0.799 . . . . 10.0 114.637 172.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 m -80.1 -30.16 39.13 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.463 1.283 . . . . 10.0 114.463 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 -22.28 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 117.001 2.223 . . . . 10.0 117.001 -166.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.9 ttt -34.76 100.52 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 129.071 2.948 . . . . 10.0 113.803 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 28.5 mt -76.41 71.74 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 125.879 1.672 . . . . 10.0 109.644 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -163.51 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.254 1.022 . . . . 10.0 113.236 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.78 -15.13 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 120.26 3.43 . . . . 10.0 120.26 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -172.67 158.52 28.69 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-N 121.695 2.043 . . . . 10.0 113.498 172.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.468 HG23 ' H ' ' A' ' 86' ' ' LYS . 16.3 tt -78.96 -79.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.111 1.523 . . . . 10.0 115.111 -169.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.468 ' H ' HG23 ' A' ' 85' ' ' ILE . 20.6 mtpt -156.9 -52.76 0.08 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.024 1.73 . . . . 10.0 111.635 -169.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -162.99 161.41 25.53 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 129.627 3.171 . . . . 10.0 107.306 174.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -57.26 -46.66 82.84 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.998 0.74 . . . . 10.0 112.998 -168.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . 0.266 83.5 m -64.56 -26.61 68.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.368 1.248 . . . . 10.0 114.368 -176.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.77 -33.84 76.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.357 1.435 . . . . 10.0 111.621 169.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.472 HH11 ' HB2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.29 -45.11 77.54 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.73 1.612 . . . . 10.0 110.121 170.039 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -63.58 -35.56 80.91 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.99 1.316 . . . . 10.0 112.363 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -63.73 -48.97 74.9 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.822 1.649 . . . . 10.0 111.243 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.42 -35.41 62.88 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.416 HD12 ' HA ' ' A' ' 61' ' ' GLU . 20.8 mm -59.37 -57.19 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.34 95.91 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.81 0.444 . . . . 10.0 111.946 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -53.53 -63.23 1.21 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.7 1.2 . . . . 10.0 111.522 170.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.24 -27.93 69.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.605 1.093 . . . . 10.0 113.426 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -59.54 -16.76 27.03 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.693 1.133 . . . . 10.0 113.511 170.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.41 33.57 3.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.801 2.04 . . . . 10.0 113.235 165.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.23 24.58 2.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.586 1.155 . . . . 10.0 111.398 171.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -127.68 2.25 6.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.573 1.549 . . . . 10.0 113.242 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -159.64 -59.0 0.06 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.344 1.857 . . . . 10.0 109.649 -154.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 C--O 1.256 1.426 0 CA-C-O 117.004 -1.474 . . . . 10.0 109.446 134.09 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.558 ' CGD' HD22 ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.029 0 CA-C-O 117.478 -1.734 . . . . 10.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -131.01 168.15 17.85 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 115.56 1.689 . . . . 10.0 115.56 -166.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.58 -65.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.23 2.612 . . . . 10.0 110.596 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.0 -37.59 74.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.404 1.482 . . . . 10.0 113.243 174.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 5.7 mmpt? -64.84 -16.4 63.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.659 -0.686 . . . . 10.0 112.315 171.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.06 -50.58 1.23 Allowed Glycine 0 N--CA 1.468 0.81 0 C-N-CA 125.974 1.749 . . . . 10.0 112.793 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -60.03 -29.62 68.62 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.629 1.215 . . . . 10.0 113.651 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.488 ' HE2' ' HE2' ' A' ' 5' ' ' LYS . 15.8 pttp -64.22 -32.18 73.66 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.995 0.918 . . . . 10.0 112.532 174.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.82 -47.93 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.603 0.761 . . . . 10.0 109.244 168.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -57.54 -53.56 56.82 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.958 0.345 . . . . 10.0 111.46 -174.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.51 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 73.4 t -63.27 -15.42 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 112.706 0.632 . . . . 10.0 112.706 -175.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -95.88 -63.74 1.12 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.051 2.141 . . . . 10.0 111.055 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -87.67 -17.9 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 -171.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -116.22 -52.63 2.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.148 0.979 . . . . 10.0 111.117 -169.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -74.57 3.71 7.27 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.564 0.95 . . . . 10.0 113.564 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.19 -67.22 0.27 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.439 1.896 . . . . 10.0 108.777 153.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 95.9 m -82.2 -35.36 28.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.137 1.375 . . . . 10.0 113.906 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.78 -163.0 0.96 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.861 2.465 . . . . 10.0 112.38 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.412 HG23 ' N ' ' A' ' 20' ' ' VAL . 8.3 t -138.15 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.477 1.111 . . . . 10.0 113.215 169.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' N ' HG23 ' A' ' 19' ' ' THR . 0.4 OUTLIER 40.97 -25.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.346 1 C-N-CA 132.86 4.464 . . . . 10.0 118.295 -161.994 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -140.55 -61.33 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.275 2.23 . . . . 10.0 109.742 -169.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -78.32 88.52 4.35 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.035 0.754 . . . . 10.0 113.035 177.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.28 -0.07 63.57 Favored Glycine 0 CA--C 1.537 1.42 0 N-CA-C 118.627 2.211 . . . . 10.0 118.627 150.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.57 -0.5 81.08 Favored Glycine 0 CA--C 1.536 1.387 0 CA-C-N 120.573 2.186 . . . . 10.0 117.241 166.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.79 155.63 38.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.03 1.332 . . . . 10.0 113.439 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -153.18 127.77 9.38 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.192 0.997 . . . . 10.0 110.056 165.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -144.44 -73.14 0.26 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.507 1.123 . . . . 10.0 110.914 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m -84.83 -16.9 39.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.368 0.667 . . . . 10.0 111.716 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -148.56 163.22 28.99 Favored Glycine 0 CA--C 1.544 1.859 0 C-N-CA 124.984 1.278 . . . . 10.0 111.662 164.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.36 175.22 2.81 Favored 'Trans proline' 0 C--N 1.353 0.794 1 C-N-CA 125.653 4.236 . . . . 10.0 113.901 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -86.9 0.39 55.09 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.598 1.333 . . . . 10.0 114.598 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 mp 58.27 -31.63 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.105 3.362 . . . . 10.0 115.714 -174.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.09 68.13 0.16 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 129.549 3.14 . . . . 10.0 113.251 176.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.45 -51.74 2.21 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 126.75 2.119 . . . . 10.0 113.867 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 tp 66.86 -58.12 0.4 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.222 2.609 . . . . 10.0 115.252 173.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.16 115.77 6.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.392 1.077 . . . . 10.0 109.588 -170.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 -8.04 71.59 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 127.076 2.274 . . . . 10.0 114.217 -174.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -87.79 -83.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.082 1.353 . . . . 10.0 114.469 -168.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.65 175.42 1.09 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.341 2.656 . . . . 10.0 111.991 161.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.1 t -82.24 166.31 19.68 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.997 2.119 . . . . 10.0 111.371 163.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 72.12 -14.64 2.16 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 126.116 1.817 . . . . 10.0 116.789 159.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.72 -5.48 5.88 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 129.042 2.937 . . . . 10.0 115.333 -173.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -46.78 128.54 8.56 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 126.009 1.724 . . . . 10.0 111.851 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -68.62 106.4 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 123.233 2.622 . . . . 10.0 111.153 -172.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.53 -44.38 1.43 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.21 1.386 . . . . 10.0 113.724 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.43 134.48 56.49 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 122.467 1.127 . . . . 10.0 110.287 -173.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.4 m -150.73 86.36 1.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 123.607 1.67 . . . . 10.0 106.823 -156.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.48 142.8 30.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 131.621 3.968 . . . . 10.0 108.305 173.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.6 t 45.36 -138.31 0.49 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.74 0.816 . . . . 10.0 111.734 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -161.24 -65.69 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.032 1.733 . . . . 10.0 110.433 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.6 -54.69 43.01 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.085 1.354 . . . . 10.0 112.607 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -56.84 -45.86 82.09 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 119.676 1.126 . . . . 10.0 112.561 175.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mmmt -53.81 -49.94 67.24 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.386 1.074 . . . . 10.0 111.722 173.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -66.03 -38.41 88.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.842 1.257 . . . . 10.0 113.219 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -161.07 81.88 0.63 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.438 1.895 . . . . 10.0 110.726 -166.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -118.24 165.58 12.79 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.369 1.462 . . . . 10.0 111.289 164.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -68.11 169.34 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.929 1.691 . . . . 10.0 114.807 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.7 m -72.22 110.19 6.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.296 1.439 . . . . 10.0 111.06 167.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -61.66 140.83 58.12 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.425 1.09 . . . . 10.0 111.388 161.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -178.31 -33.03 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 125.731 1.612 . . . . 10.0 114.998 -169.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 166.46 -61.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.696 2.798 . . . . 10.0 112.306 158.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -41.49 85.31 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.84 1.256 . . . . 10.0 112.091 -177.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -54.71 -38.86 67.58 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.596 1.159 . . . . 10.0 112.579 168.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.2 mp -75.35 -28.64 59.66 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 119.881 1.219 . . . . 10.0 113.579 172.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 38.3 mtt -61.53 -53.61 54.11 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.987 1.267 . . . . 10.0 108.589 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.14 -37.81 88.6 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.699 0.285 . . . . 10.0 110.977 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.04 -45.54 81.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.198 -0.906 . . . . 10.0 113.183 175.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -37.88 89.05 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 120.931 1.696 . . . . 10.0 111.633 176.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -70.2 -24.65 63.15 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.726 1.38 . . . . 10.0 114.726 174.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.8 75.71 2.3 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 119.855 1.207 . . . . 10.0 114.01 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -70.88 -45.71 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.973 1.782 . . . . 10.0 112.224 -168.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -68.84 21.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.82 2.848 . . . . 10.0 114.658 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -161.47 -30.75 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.843 1.657 . . . . 10.0 112.786 -167.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.774 1.028 . . . . 10.0 113.774 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.11 157.11 79.11 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 125.419 1.488 . . . . 10.0 110.257 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.11 117.92 5.26 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.604 2.203 . . . . 10.0 110.603 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 85.64 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.802 1.191 . . . . 10.0 113.612 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -127.28 150.61 49.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.053 1.341 . . . . 10.0 110.53 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -142.0 26.6 1.85 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.763 1.625 . . . . 10.0 113.118 -171.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 14.3 ttt -55.8 103.97 0.12 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.84 0.856 . . . . 10.0 110.554 159.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.73 79.98 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.578 1.151 . . . . 10.0 109.467 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -161.91 -63.29 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.153 0.581 . . . . 10.0 111.983 174.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.48 -2.63 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 120.495 3.517 . . . . 10.0 120.495 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -145.6 86.47 0.17 Allowed Glycine 0 CA--C 1.529 0.937 0 CA-C-N 120.9 1.682 . . . . 10.0 112.262 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.8 tt -64.24 -57.76 10.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 114.12 1.155 . . . . 10.0 114.12 -170.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm 163.4 -168.75 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 131.667 3.987 . . . . 10.0 109.095 -174.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -53.12 -61.78 2.07 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 128.335 2.654 . . . . 10.0 115.582 -167.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.5 -40.61 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.518 1.527 . . . . 10.0 114.456 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -50.82 60.31 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.397 1.479 . . . . 10.0 111.656 -173.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -53.9 -49.06 69.43 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.389 0.675 . . . . 10.0 110.994 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -33.34 75.24 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.517 1.127 . . . . 10.0 112.788 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -76.68 -33.88 58.23 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 120.394 1.452 . . . . 10.0 114.428 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -69.91 -46.5 65.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.606 1.094 . . . . 10.0 112.069 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.675 HD21 HMB1 ' A' ' 105' ' ' HEC . 12.7 tp -59.58 -39.99 85.91 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.75 1.22 . . . . 10.0 113.265 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mm -65.0 -44.01 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.289 1.036 . . . . 10.0 110.479 173.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.73 -41.2 97.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.299 0.64 . . . . 10.0 111.75 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -56.72 -59.01 5.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.203 1.001 . . . . 10.0 112.418 170.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.8 -27.68 66.08 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.931 1.086 . . . . 10.0 113.931 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -58.89 -28.19 65.92 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.654 1.182 . . . . 10.0 112.637 167.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -81.94 -51.92 7.59 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.931 1.293 . . . . 10.0 111.549 167.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.45 -12.52 15.07 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 116.39 1.996 . . . . 10.0 116.39 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.3 t -72.3 -0.8 13.18 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.723 -1.235 . . . . 10.0 114.312 164.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -151.12 -22.32 0.21 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.94 1.696 . . . . 10.0 113.519 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 127.652 2.381 . . . . 10.0 109.965 172.148 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.675 HMB1 HD21 ' A' ' 94' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.822 0 CA-C-O 119.263 -0.743 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -127.78 136.55 51.64 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.623 0.725 . . . . 10.0 112.583 -150.096 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.49 -58.86 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.141 1.777 . . . . 10.0 110.989 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -60.25 -48.58 81.11 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.031 1.333 . . . . 10.0 113.153 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -53.33 -35.01 59.73 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.497 0.719 . . . . 10.0 111.721 170.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.31 -53.55 7.56 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.934 1.254 . . . . 10.0 110.38 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 97' ' ' TYR . 1.2 ptpt -58.75 -44.73 90.62 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.346 1.573 . . . . 10.0 112.679 177.154 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -39.7 79.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 118.07 -0.967 . . . . 10.0 112.898 -178.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -73.47 -33.16 39.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.929 1.241 . . . . 10.0 111.955 174.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -56.78 -50.56 71.95 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.284 -0.885 . . . . 10.0 110.077 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.487 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 55.2 t -60.15 -14.29 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 177.255 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -94.22 -56.62 2.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.267 1.427 . . . . 10.0 111.503 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -108.11 1.66 22.45 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.15 1.537 . . . . 10.0 115.15 -172.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.0 m -123.8 -49.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.126 1.37 . . . . 10.0 112.455 -179.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.487 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . . . -69.68 2.93 2.81 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.921 1.082 . . . . 10.0 113.921 178.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -59.03 6.1 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.477 -0.764 . . . . 10.0 109.359 158.215 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.4 m -87.58 -28.06 22.16 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.608 1.336 . . . . 10.0 114.608 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -108.35 -168.95 1.43 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.795 2.038 . . . . 10.0 111.558 -176.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.285 6.5 t -137.33 -75.17 0.41 Allowed 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 117.471 -1.252 . . . . 10.0 113.33 165.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 6.7 p 45.58 -56.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 130.394 3.478 . . . . 10.0 116.587 -170.553 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -67.93 -10.14 50.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.245 1.818 . . . . 10.0 113.309 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -152.71 148.68 27.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.391 1.877 . . . . 10.0 110.356 -171.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.0 76.6 1.59 Allowed Glycine 0 CA--C 1.527 0.808 0 C-N-CA 125.486 1.517 . . . . 10.0 112.905 -176.359 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.77 -139.87 8.9 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.674 1.13 . . . . 10.0 111.267 169.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 64.51 0.24 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.352 1.061 . . . . 10.0 109.729 169.62 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 59.11 178.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.836 1.654 . . . . 10.0 110.891 -170.359 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -150.82 -110.17 0.06 Allowed 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.97 -1.081 . . . . 10.0 109.454 156.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.0 m -72.18 -27.74 62.77 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.266 1.826 . . . . 10.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -122.67 176.91 16.57 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 126.047 1.784 . . . . 10.0 111.471 166.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.89 177.13 8.07 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.952 3.101 . . . . 10.0 112.266 177.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.53 10.48 27.71 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.941 2.096 . . . . 10.0 114.743 -175.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 mp 57.6 -16.59 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 128.809 2.844 . . . . 10.0 116.029 -176.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 33.94 68.99 0.15 Allowed 'General case' 0 C--O 1.24 0.591 0 C-N-CA 129.546 3.138 . . . . 10.0 115.768 156.738 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 67.02 2.37 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 125.503 1.525 . . . . 10.0 111.11 -176.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.01 171.29 2.28 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 117.993 0.896 . . . . 10.0 112.304 -176.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 76.37 130.09 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 127.642 2.377 . . . . 10.0 114.424 171.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.44 -39.82 1.5 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.004 1.764 . . . . 10.0 113.822 -179.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -169.93 0.68 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.777 1.631 . . . . 10.0 113.929 174.089 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.2 mtmm -77.43 -164.43 0.48 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.793 1.637 . . . . 10.0 113.036 -174.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -107.3 -99.03 0.36 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 117.586 -1.197 . . . . 10.0 109.981 168.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 7.54 -103.94 0.01 OUTLIER Glycine 0 N--CA 1.477 1.389 0 C-N-CA 130.144 3.735 . . . . 10.0 117.743 -177.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 46.42 -14.27 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.087 1 C-N-CA 133.179 4.592 . . . . 10.0 121.695 161.208 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 109.98 2.85 Favored Pre-proline 0 CA--C 1.553 1.094 0 CA-C-N 121.377 1.899 . . . . 10.0 114.04 -174.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.26 62.59 8.49 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 124.037 3.158 . . . . 10.0 113.593 -167.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.45 50.97 0.08 OUTLIER Glycine 0 N--CA 1.473 1.11 0 C-N-CA 124.924 1.25 . . . . 10.0 113.299 175.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -145.92 -177.86 5.81 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.197 2.199 . . . . 10.0 108.078 -176.026 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.7 m -154.49 135.53 13.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 119.715 -1.866 . . . . 10.0 109.105 176.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -138.64 173.83 11.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.09 1.356 . . . . 10.0 112.061 -166.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.8 p -69.63 160.49 31.47 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.185 1.394 . . . . 10.0 112.557 172.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -64.8 -178.19 0.4 Allowed 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 114.916 -1.038 . . . . 10.0 111.041 161.44 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.02 -72.0 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.914 2.485 . . . . 10.0 114.02 -173.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -62.36 -64.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.153 0.978 . . . . 10.0 112.273 -169.09 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.406 ' HE3' HBD2 ' A' ' 105' ' ' HEC . 0.0 OUTLIER -77.71 -39.64 43.95 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.531 -1.355 . . . . 10.0 113.869 175.308 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -65.63 -60.74 2.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.881 0.764 . . . . 10.0 112.741 178.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 56' ' ' GLY . 0.2 OUTLIER -77.37 -48.56 16.98 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.646 0.778 . . . . 10.0 112.766 -176.843 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 55' ' ' LYS . . . 71.11 176.3 23.03 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.123 1.344 . . . . 10.0 115.481 -177.82 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -168.46 2.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 127.568 2.347 . . . . 10.0 112.099 -165.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . 0.266 2.4 m 53.83 113.64 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 128.022 2.529 . . . . 10.0 114.979 -174.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.52 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 38.3 m95 -64.5 156.22 30.35 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.524 -1.216 . . . . 10.0 110.26 163.146 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -174.43 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.697 1.599 . . . . 10.0 112.104 -175.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 165.69 -64.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 130.484 3.514 . . . . 10.0 110.012 173.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -46.11 -56.54 5.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.357 1.863 . . . . 10.0 112.769 -179.764 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 75.7 p -61.41 -36.01 79.12 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.679 1.592 . . . . 10.0 112.163 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.466 HD22 HH12 ' A' ' 91' ' ' ARG . 0.4 OUTLIER -75.32 -32.37 60.91 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.137 0.975 . . . . 10.0 113.051 173.918 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.9 mtm -63.62 -47.64 80.57 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 118.091 -0.957 . . . . 10.0 109.504 173.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -66.0 -43.01 88.99 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.554 0.616 . . . . 10.0 111.14 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -63.06 -49.8 73.11 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -177.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -43.11 92.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.779 1.172 . . . . 10.0 110.58 -178.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -74.11 -20.93 60.09 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.712 1.375 . . . . 10.0 114.712 -177.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.32 72.12 2.58 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 118.912 0.778 . . . . 10.0 111.355 178.212 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' HG21 ' A' ' 78' ' ' THR . 12.4 Cg_endo -62.91 -61.49 0.14 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.846 3.031 . . . . 10.0 115.44 -165.317 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -68.93 -26.06 64.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.035 0.934 . . . . 10.0 111.694 -178.127 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.38 90.95 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.861 1.264 . . . . 10.0 110.909 166.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -76.21 -53.9 7.58 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.266 -0.896 . . . . 10.0 113.299 178.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.56 119.51 15.18 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.952 1.301 . . . . 10.0 109.37 171.167 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.35 -30.71 44.53 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.864 2.376 . . . . 10.0 113.515 -168.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -74.92 70.62 1.75 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.177 0.894 . . . . 10.0 111.625 172.334 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.477 HG21 ' HB2' ' A' ' 71' ' ' PRO . 2.6 m -138.84 152.41 47.82 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.997 0.919 . . . . 10.0 111.43 172.607 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -141.41 12.87 2.16 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.237 1.815 . . . . 10.0 113.327 -178.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.2 ttt -55.03 93.02 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.255 1.822 . . . . 10.0 111.967 165.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.9 mm -71.79 76.65 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 124.812 1.245 . . . . 10.0 110.086 176.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -162.18 -74.09 0.05 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.959 0.726 . . . . 10.0 112.959 176.33 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.73 -67.94 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.443 2.697 . . . . 10.0 116.46 -169.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.9 82.1 0.12 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 125.984 1.754 . . . . 10.0 112.653 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 tt -61.43 -43.83 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 123.905 0.882 . . . . 10.0 112.293 -165.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.253 10.8 mtpt 161.45 -78.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 130.938 3.695 . . . . 10.0 110.061 146.026 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -77.0 -83.59 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt 173.69 -43.76 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 128.12 2.568 . . . . 10.0 110.706 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.7 m -50.53 -40.59 52.1 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.334 1.853 . . . . 10.0 112.168 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -59.89 -39.78 86.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.446 0.698 . . . . 10.0 111.072 177.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.466 HH12 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -62.67 -51.2 68.19 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.104 1.362 . . . . 10.0 109.881 -179.354 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.07 -26.68 59.54 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.053 1.131 . . . . 10.0 114.053 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -66.66 -43.06 85.56 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.605 1.093 . . . . 10.0 110.916 168.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.35 -35.71 72.36 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.439 1.274 . . . . 10.0 114.439 174.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.36 -55.88 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 172.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -43.9 88.74 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.251 0.621 . . . . 10.0 111.946 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 101' ' ' ALA . 3.0 t80 -52.84 -63.41 1.15 Allowed 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.776 1.23 . . . . 10.0 111.739 170.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 101' ' ' ALA . 89.6 mt -64.23 -30.1 71.17 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.719 1.145 . . . . 10.0 112.334 -174.335 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -57.69 -32.93 67.85 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.241 1.017 . . . . 10.0 112.497 171.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.5 mmtt -80.62 -53.37 6.6 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 125.065 1.346 . . . . 10.0 111.98 165.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.482 ' HB2' ' CE1' ' A' ' 97' ' ' TYR . . . -55.79 -24.3 34.96 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.319 1.97 . . . . 10.0 116.319 -167.143 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.5 t -74.14 2.11 9.7 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.126 0.971 . . . . 10.0 113.599 171.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -152.99 -18.55 0.15 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 127.941 2.496 . . . . 10.0 114.981 -179.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.064 2.146 . . . . 10.0 113.316 -171.996 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.52 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 109.266 -1.533 . . . . 10.0 109.266 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.569 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 1.8 m-20 -114.87 -113.56 0.34 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.463 1.505 . . . . 10.0 111.357 -165.397 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -161.51 -59.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 128.39 2.676 . . . . 10.0 107.499 -179.137 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.06 -48.83 75.31 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.398 1.079 . . . . 10.0 112.405 176.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -62.18 -14.89 42.28 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.965 1.098 . . . . 10.0 113.965 172.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.45 -55.8 2.52 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 125.292 1.425 . . . . 10.0 110.032 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 pttt -61.19 -37.48 83.11 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.144 0.972 . . . . 10.0 113.197 -176.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -13.95 60.91 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.216 1.191 . . . . 10.0 114.216 176.578 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.1 mm -103.22 -34.61 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.593 1.157 . . . . 10.0 111.222 169.711 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.6 t80 -54.67 -53.15 58.61 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.611 0.641 . . . . 10.0 110.793 172.065 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -66.61 -8.04 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.513 -0.742 . . . . 10.0 112.637 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.84 -50.04 5.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.501 1.92 . . . . 10.0 111.224 -177.078 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -122.82 -1.23 8.94 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -174.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 22.0 m -117.48 -46.2 2.69 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.562 1.145 . . . . 10.0 111.358 -177.355 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.08 -10.75 6.68 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.063 0.764 . . . . 10.0 113.063 168.296 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -19.02 40.31 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.716 1.606 . . . . 10.0 113.042 166.148 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -143.4 -26.59 0.57 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.537 1.935 . . . . 10.0 115.074 -177.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -110.18 -172.84 2.12 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 128.056 2.542 . . . . 10.0 110.727 179.102 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.7 p -131.16 -82.68 0.52 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.863 1.06 . . . . 10.0 113.863 169.592 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.294 9.9 p 50.96 -45.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 131.507 3.923 . . . . 10.0 116.502 -169.752 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -72.81 -4.33 30.97 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.096 1.358 . . . . 10.0 112.165 170.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -151.66 173.41 14.71 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.588 1.955 . . . . 10.0 110.031 -166.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.4 64.77 1.71 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.206 1.384 . . . . 10.0 116.512 -163.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.51 0.62 8.48 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.267 2.067 . . . . 10.0 118.267 156.518 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -61.75 73.11 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 128.504 2.722 . . . . 10.0 112.642 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.26 77.18 0.25 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.489 1.138 . . . . 10.0 110.872 167.862 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -73.71 -22.99 59.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.317 2.247 . . . . 10.0 113.538 178.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.6 m -161.2 -28.63 0.05 Allowed 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.548 -0.72 . . . . 10.0 112.904 -174.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -123.12 160.43 17.63 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.828 1.204 . . . . 10.0 111.116 166.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -66.56 6.45 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.742 1 C-N-CA 126.905 5.07 . . . . 10.0 117.378 -162.416 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 61.77 159.74 0.06 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.968 2.107 . . . . 10.0 112.171 -147.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.76 78.35 9.58 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.334 -1.358 . . . . 10.0 107.334 165.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 83.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.467 1.107 . . . . 10.0 110.928 176.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 64.87 -67.66 0.07 OUTLIER Glycine 0 CA--C 1.529 0.936 0 C-N-CA 128.047 2.737 . . . . 10.0 113.158 -178.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.57 -179.84 0.16 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.503 2.721 . . . . 10.0 111.43 -169.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 67.79 82.58 0.17 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.448 1.899 . . . . 10.0 113.504 -174.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.68 -33.69 4.02 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.234 1.873 . . . . 10.0 112.602 169.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -77.62 -168.16 1.12 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.046 1.338 . . . . 10.0 111.576 165.537 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.63 158.5 44.23 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.826 1.25 . . . . 10.0 110.044 -167.87 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -62.25 158.99 15.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 115.357 1.614 . . . . 10.0 115.357 -169.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.65 7.9 38.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.436 1.735 . . . . 10.0 117.436 169.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -100.65 12.35 37.6 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.693 1.738 . . . . 10.0 115.693 -161.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.42 146.08 89.91 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.031 0.932 . . . . 10.0 113.513 -178.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.63 58.92 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.727 2.951 . . . . 10.0 113.709 178.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 106.96 0.78 36.12 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 125.459 1.504 . . . . 10.0 116.134 168.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.63 132.97 51.23 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.969 1.385 . . . . 10.0 113.266 179.071 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -71.78 84.93 0.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.977 1.711 . . . . 10.0 112.219 175.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.404 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -82.77 175.19 10.31 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.105 1.362 . . . . 10.0 111.478 163.872 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -69.94 158.61 35.28 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.249 -0.907 . . . . 10.0 110.482 171.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 17.4 t0 -75.62 -9.32 58.49 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -178.479 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.16 -77.95 0.21 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.001 0.92 . . . . 10.0 113.162 -170.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -68.11 -23.81 64.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.828 1.418 . . . . 10.0 114.828 -163.084 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HG2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -64.62 -34.94 79.45 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.672 1.124 . . . . 10.0 113.3 169.501 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.82 -69.11 0.35 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.852 0.751 . . . . 10.0 110.693 162.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -76.92 60.81 1.84 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 10.0 112.414 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -85.09 -162.47 35.65 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.539 1.542 . . . . 10.0 114.637 -177.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.0 pt -169.06 146.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 127.79 2.436 . . . . 10.0 107.945 -166.468 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.0 m -72.59 124.4 25.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.058 1.343 . . . . 10.0 110.302 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -75.41 130.99 39.87 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 123.178 0.591 . . . . 10.0 111.277 175.651 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -164.47 161.49 21.4 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.447 2.299 . . . . 10.0 108.942 -168.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.99 46.82 0.06 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.58 1.952 . . . . 10.0 113.374 176.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -162.35 -62.14 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 129.25 3.02 . . . . 10.0 107.543 -171.171 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 44.5 p -65.99 -29.62 70.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 117.681 -1.152 . . . . 10.0 113.05 -177.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.27 -26.65 60.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.679 1.127 . . . . 10.0 112.908 169.577 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.2 mtt -65.54 -53.47 41.69 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.824 1.193 . . . . 10.0 108.421 172.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -67.33 -38.94 85.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.68 -0.236 . . . . 10.0 111.006 -176.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -60.72 -63.31 1.34 Allowed 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 119.044 -0.503 . . . . 10.0 111.453 173.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -32.83 74.56 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 120.155 1.343 . . . . 10.0 111.615 -169.941 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.48 -17.64 55.98 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.922 1.453 . . . . 10.0 114.922 175.501 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.09 56.26 0.81 Allowed Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.329 1.452 . . . . 10.0 112.189 -169.574 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.8 -50.92 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.661 2.241 . . . . 10.0 112.772 -159.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -64.27 -24.77 67.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.462 1.905 . . . . 10.0 112.865 -177.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -75.34 -54.13 7.58 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.948 1.299 . . . . 10.0 110.546 167.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -69.54 -30.71 68.58 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.934 1.087 . . . . 10.0 113.934 -170.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 pt -140.43 118.13 8.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.465 1.106 . . . . 10.0 109.963 163.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.8 151.69 74.17 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.501 2.134 . . . . 10.0 111.484 -176.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.37 5.49 67.33 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 118.726 -1.041 . . . . 10.0 115.223 179.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.5 t -75.25 -3.56 33.93 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 116.258 1.947 . . . . 10.0 116.258 -170.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.2 tptp 59.28 -18.88 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 119.316 3.08 . . . . 10.0 119.316 159.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 19.3 ttt -46.32 114.6 0.83 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.904 2.481 . . . . 10.0 112.058 178.0 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.6 mp -82.43 52.72 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.715 1.206 . . . . 10.0 110.427 -176.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -164.06 150.98 11.7 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.02 1.728 . . . . 10.0 108.939 169.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.28 139.36 5.82 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.424 1.49 . . . . 10.0 108.69 177.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.19 87.88 0.49 Allowed Glycine 0 CA--C 1.529 0.911 0 CA-C-N 118.084 0.402 . . . . 10.0 112.837 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.3 tt -68.51 12.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.977 1.843 . . . . 10.0 115.977 -166.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 59.4 -0.26 0.18 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.881 2.549 . . . . 10.0 117.881 173.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -160.27 104.12 1.46 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.879 2.072 . . . . 10.0 109.199 -168.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -67.67 -13.77 62.37 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.338 1.607 . . . . 10.0 115.338 -177.319 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -62.76 -63.22 1.28 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.005 0.821 . . . . 10.0 109.323 163.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -50.87 -34.71 29.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.447 1.899 . . . . 10.0 112.814 176.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 1.2 tpm_? -51.18 -50.08 59.69 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 174.049 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -75.52 -43.47 48.79 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.952 1.701 . . . . 10.0 110.641 175.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.569 ' CG ' ' H ' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -57.3 -50.13 73.89 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.078 1.751 . . . . 10.0 112.124 -174.226 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -65.79 -38.68 89.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 118.4 0.546 . . . . 10.0 112.232 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.8 mt -61.38 -48.82 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.414 0.686 . . . . 10.0 109.492 176.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.67 93.85 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.748 1.219 . . . . 10.0 112.868 176.22 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.422 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -50.16 -53.29 28.72 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.023 1.329 . . . . 10.0 111.394 169.651 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 35.8 mt -67.54 -31.58 71.78 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.381 -0.824 . . . . 10.0 112.843 178.534 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -59.61 -26.88 65.82 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.323 1.231 . . . . 10.0 114.323 167.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.79 -54.36 9.07 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.011 0.823 . . . . 10.0 109.998 162.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.19 -25.48 33.02 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.512 1.671 . . . . 10.0 115.512 -175.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.25 5.6 11.89 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.052 1.341 . . . . 10.0 114.161 172.584 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -150.21 -15.63 0.25 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.564 1.946 . . . . 10.0 113.72 -170.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 C--O 1.258 1.515 0 C-N-CA 126.873 2.069 . . . . 10.0 110.221 -161.488 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.286 0 CA-C-O 119.59 -0.561 . . . . 10.0 111.973 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -131.79 122.3 25.57 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.299 1.04 . . . . 10.0 111.134 -157.068 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.9 t -52.82 -55.95 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.012 1.725 . . . . 10.0 111.71 -169.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.8 -44.16 90.71 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 113.646 0.98 . . . . 10.0 113.646 -178.196 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.1 -36.12 72.42 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.156 0.582 . . . . 10.0 110.195 172.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.75 -45.54 16.87 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 124.68 1.133 . . . . 10.0 110.972 -175.029 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -74.95 -29.12 60.85 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 176.377 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -60.86 -53.48 56.78 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.43 1.013 . . . . 10.0 111.051 168.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.9 tp -64.23 -32.28 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 118.787 0.721 . . . . 10.0 112.001 177.34 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.494 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 36.7 t80 -59.37 -56.93 15.77 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 118.912 0.778 . . . . 10.0 111.311 170.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.32 -9.06 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 O-C-N 121.633 -0.667 . . . . 10.0 112.713 -178.353 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -63.67 1.25 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.743 1.217 . . . . 10.0 110.501 173.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -113.61 -2.78 13.72 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.774 1.768 . . . . 10.0 115.774 -167.795 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 35.3 m -103.44 -42.96 5.54 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 124.234 1.014 . . . . 10.0 111.23 171.051 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.01 -9.57 4.54 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.233 1.198 . . . . 10.0 114.233 173.191 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.73 -16.43 63.76 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.226 1.41 . . . . 10.0 112.979 167.855 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -143.54 -33.9 0.42 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.828 1.651 . . . . 10.0 113.928 -177.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.403 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 93.2 m-70 -100.76 -178.16 3.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.372 2.269 . . . . 10.0 110.621 173.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.4 t -175.74 117.25 0.15 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.38 1.072 . . . . 10.0 110.771 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.4 p -143.74 -63.64 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.217 1.407 . . . . 10.0 112.761 -173.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -66.45 -32.21 73.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 120.87 1.668 . . . . 10.0 110.507 170.153 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -68.05 120.74 14.78 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.745 1.218 . . . . 10.0 109.065 156.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.81 65.16 1.84 Allowed Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.91 0.767 . . . . 10.0 112.914 174.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.91 -146.24 13.04 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.226 1.393 . . . . 10.0 114.376 -175.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 pttp -161.68 69.77 0.32 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.683 1.593 . . . . 10.0 112.061 -167.647 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p80 34.28 80.72 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.337 2.655 . . . . 10.0 115.08 163.753 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -68.53 -47.94 65.62 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.011 1.725 . . . . 10.0 112.944 -168.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -152.51 -23.49 0.17 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.424 1.49 . . . . 10.0 111.923 -166.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.403 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -119.71 -178.94 16.51 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 126.3 1.905 . . . . 10.0 108.934 155.462 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 92.9 Cg_endo -72.84 -176.45 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 CA-C-N 120.03 1.915 . . . . 10.0 111.251 176.377 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -64.42 -35.92 82.48 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 179.342 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp 67.53 68.48 0.37 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.832 2.853 . . . . 10.0 111.006 -150.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.88 73.71 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.47 1.908 . . . . 10.0 112.619 161.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.58 -67.48 0.41 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 127.402 2.429 . . . . 10.0 114.706 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 54.1 -163.79 0.11 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.116 2.166 . . . . 10.0 113.084 -169.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 67.86 10.14 7.59 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.105 2.562 . . . . 10.0 114.743 -176.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -160.17 13.06 0.18 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.787 1.66 . . . . 10.0 114.16 -179.475 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.51 169.29 24.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.826 1.25 . . . . 10.0 111.943 -177.194 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -65.04 163.28 15.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.85 1.66 . . . . 10.0 112.564 179.245 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.4 p -69.82 164.58 23.34 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.414 0.686 . . . . 10.0 110.957 170.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 107.46 -112.76 3.78 Favored Glycine 0 N--CA 1.47 0.938 0 CA-C-O 118.193 -1.337 . . . . 10.0 115.68 169.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 38.37 2.41 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 1 C-N-CA 132.02 4.128 . . . . 10.0 121.104 178.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 30' ' ' PRO . . . -44.89 104.25 0.38 Allowed Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 127.653 2.381 . . . . 10.0 114.814 -178.612 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.91 50.73 3.57 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 123.778 2.985 . . . . 10.0 113.217 -172.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.69 49.75 0.1 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.573 1.558 . . . . 10.0 113.853 176.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 48' ' ' TYR . 2.9 t80 -148.97 118.0 6.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.257 1.023 . . . . 10.0 110.868 176.327 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.3 m -72.34 118.04 14.74 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.857 1.663 . . . . 10.0 111.088 176.35 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.701 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -127.89 177.19 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.371 1.868 . . . . 10.0 112.337 -175.639 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.6 p -77.65 142.66 38.73 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.282 -0.886 . . . . 10.0 111.788 168.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -65.11 -171.96 0.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.207 2.203 . . . . 10.0 112.769 163.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 59.1 -67.13 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.445 2.698 . . . . 10.0 112.093 -166.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -47.77 -31.73 5.17 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 130.209 3.404 . . . . 10.0 113.769 -179.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.701 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 27.4 mtmm -158.7 4.3 0.1 Allowed 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 129.029 2.931 . . . . 10.0 112.467 -162.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.71 -62.48 1.37 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.672 0.789 . . . . 10.0 111.098 138.026 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -19.74 58.58 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.304 1.442 . . . . 10.0 114.812 -163.785 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.28 28.05 46.13 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-O 117.471 -1.738 . . . . 10.0 116.358 161.559 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 pp -54.98 20.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 130.346 3.458 . . . . 10.0 119.801 -167.418 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.2 m 55.64 99.27 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 128.865 2.866 . . . . 10.0 115.033 177.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -70.47 124.46 24.25 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.606 -0.684 . . . . 10.0 111.238 167.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.0 ptmt -163.86 170.18 17.18 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 129.565 3.146 . . . . 10.0 107.82 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -56.13 -33.61 65.33 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.519 1.303 . . . . 10.0 114.519 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -60.86 -65.28 0.72 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.454 1.102 . . . . 10.0 111.887 171.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.0 p -62.69 -39.51 94.2 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.637 1.175 . . . . 10.0 111.981 -175.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.67 -16.99 59.39 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 174.954 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 29.0 mtm -68.27 -60.42 2.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.629 1.104 . . . . 10.0 108.741 160.566 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.63 -43.85 72.64 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.872 0.733 . . . . 10.0 111.006 -175.772 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -64.8 -54.97 22.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.151 -0.928 . . . . 10.0 113.07 178.038 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -26.09 65.37 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.741 1.61 . . . . 10.0 113.644 -178.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.46 -36.45 79.01 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.933 1.242 . . . . 10.0 112.614 171.153 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -161.58 96.01 1.3 Allowed Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.721 1.146 . . . . 10.0 112.594 169.638 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.67 -44.11 0.76 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.416 2.077 . . . . 10.0 111.098 -167.237 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -71.66 -24.08 61.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.092 1.757 . . . . 10.0 114.342 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -75.99 -40.11 54.47 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.886 1.221 . . . . 10.0 112.469 162.418 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -68.27 -41.06 81.62 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.258 0.836 . . . . 10.0 113.258 -176.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.47 156.96 69.29 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.244 1.018 . . . . 10.0 111.967 169.29 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.02 164.95 24.56 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.158 2.572 . . . . 10.0 114.833 -172.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.52 -77.43 0.09 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 127.157 2.313 . . . . 10.0 112.082 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 m 58.8 -40.65 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 130.297 3.439 . . . . 10.0 118.954 164.266 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt 55.49 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 117.85 2.537 . . . . 10.0 117.85 174.629 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.0 ttt -64.59 79.52 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.054 1.742 . . . . 10.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tp -70.56 79.51 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.905 1.682 . . . . 10.0 111.395 178.096 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -161.12 -60.6 0.05 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 117.873 -1.061 . . . . 10.0 113.561 -176.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.14 91.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.931 2.197 . . . . 10.0 116.931 172.069 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.58 105.53 1.94 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 124.354 0.978 . . . . 10.0 111.285 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.5 tt -62.92 -56.3 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.439 0.903 . . . . 10.0 113.439 -165.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -162.34 -66.27 0.05 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.537 1.935 . . . . 10.0 111.111 174.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.9 mtmt -161.67 169.85 20.81 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.693 2.397 . . . . 10.0 107.886 -162.788 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -75.38 -11.35 60.03 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 115.876 1.806 . . . . 10.0 115.876 -167.138 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.6 m -75.6 -56.17 4.95 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.942 1.247 . . . . 10.0 109.418 169.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -53.83 -36.79 62.93 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.819 2.047 . . . . 10.0 111.329 178.378 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -53.73 -46.11 70.74 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 126.833 2.053 . . . . 10.0 114.188 171.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -73.14 -45.12 58.55 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.112 0.965 . . . . 10.0 110.587 173.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -56.77 -49.23 75.92 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.781 1.232 . . . . 10.0 111.312 -170.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.1 -50.28 73.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.602 1.161 . . . . 10.0 112.538 174.365 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.8 mm -58.09 -47.18 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.182 0.993 . . . . 10.0 109.733 177.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.21 -47.32 85.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.585 1.154 . . . . 10.0 111.864 177.736 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -56.14 -56.79 16.61 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 118.661 -0.685 . . . . 10.0 112.081 173.375 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.69 -33.37 74.78 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.237 0.926 . . . . 10.0 112.484 -174.682 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -70.97 -23.58 62.24 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.381 1.252 . . . . 10.0 114.381 174.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -73.34 -59.23 2.81 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.687 -1.149 . . . . 10.0 110.825 159.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.86 -22.61 38.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 115.671 1.73 . . . . 10.0 115.671 -169.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 t -76.63 4.21 9.91 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.342 1.457 . . . . 10.0 114.582 169.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -150.37 -32.98 0.18 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.251 2.22 . . . . 10.0 112.925 -170.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 . . . . . 0 C--O 1.251 1.135 0 C-N-CA 127.595 2.358 . . . . 10.0 110.149 -156.93 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.988 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -156.67 170.94 21.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.941 1.371 . . . . 10.0 110.367 161.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.4 t -70.08 -67.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 126.267 1.827 . . . . 10.0 109.842 172.413 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -37.97 89.37 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.78 1.232 . . . . 10.0 112.509 179.74 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 mttp -73.17 4.56 4.31 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 118.094 -0.955 . . . . 10.0 113.422 168.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.63 -32.44 3.38 Favored Glycine 0 N--CA 1.472 1.036 0 CA-C-N 119.832 1.197 . . . . 10.0 114.505 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -29.72 65.4 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.791 1.796 . . . . 10.0 112.429 169.917 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.475 ' HE2' ' HB ' ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.06 -15.73 63.31 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.372 1.619 . . . . 10.0 115.372 179.039 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.475 ' HB ' ' HE2' ' A' ' 8' ' ' LYS . 10.9 tp -110.46 -32.16 2.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.82 1.248 . . . . 10.0 111.252 170.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -54.61 -54.92 35.02 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 118.567 0.621 . . . . 10.0 110.088 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.32 -9.84 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.898 0.879 . . . . 10.0 112.673 -178.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -99.45 -35.81 9.78 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.26 1.824 . . . . 10.0 112.869 -173.348 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.42 -57.73 2.04 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.3 1.04 . . . . 10.0 111.709 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -56.52 -48.91 76.21 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.343 1.057 . . . . 10.0 112.24 -176.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.84 3.2 3.43 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.924 1.453 . . . . 10.0 114.924 174.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.37 -11.69 61.08 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 120.169 1.35 . . . . 10.0 111.854 162.089 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.18 -47.13 0.35 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.402 1.481 . . . . 10.0 112.33 -174.538 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -88.77 -170.71 3.03 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 127.194 2.197 . . . . 10.0 111.751 176.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.568 HG23 ' H ' ' A' ' 20' ' ' VAL . 5.1 t -131.52 -76.49 0.52 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.774 1.23 . . . . 10.0 113.666 -178.388 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' H ' HG23 ' A' ' 19' ' ' THR . 31.0 t 59.06 -60.46 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 129.925 3.29 . . . . 10.0 113.87 -174.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -128.35 -23.99 3.16 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 128.421 2.688 . . . . 10.0 110.52 -173.019 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -77.36 72.41 3.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.149 1.38 . . . . 10.0 110.681 168.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.39 -86.38 0.02 OUTLIER Glycine 0 CA--C 1.534 1.27 0 C-N-CA 127.597 2.522 . . . . 10.0 115.613 169.797 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.1 104.08 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 124.255 0.931 . . . . 10.0 112.244 -178.267 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -164.26 159.71 20.3 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.289 1.836 . . . . 10.0 112.225 178.687 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -157.3 108.96 2.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.066 1.746 . . . . 10.0 107.746 175.69 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -141.58 127.77 19.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.441 2.296 . . . . 10.0 107.747 -169.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.498 ' O ' HMD3 ' A' ' 105' ' ' HEC . 32.1 m 56.36 -26.8 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 127.73 2.412 . . . . 10.0 115.74 -169.609 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -125.02 172.48 17.13 Favored Glycine 0 CA--C 1.544 1.889 0 C-N-CA 127.336 2.398 . . . . 10.0 111.885 160.549 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -75.87 -128.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 125.692 4.262 . . . . 10.0 110.725 175.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -144.76 -173.36 4.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.341 1.857 . . . . 10.0 109.784 -178.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.14 65.18 1.4 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 122.445 1.116 . . . . 10.0 109.497 175.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.31 77.06 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 128.16 2.584 . . . . 10.0 112.483 164.525 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 67.49 -58.31 0.3 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 128.976 3.179 . . . . 10.0 112.505 -172.387 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . 0.263 0.1 OUTLIER 48.19 -106.54 0.17 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.658 2.383 . . . . 10.0 111.378 -165.516 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.327 9.6 m-85 33.86 39.7 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.171 2.988 . . . . 10.0 117.258 171.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 131.81 -16.08 5.08 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 126.82 2.153 . . . . 10.0 115.801 -175.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -64.23 -88.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.448 2.124 . . . . 10.0 113.967 -176.632 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.01 168.53 3.46 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 128.365 2.666 . . . . 10.0 111.641 163.159 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.7 p -67.53 163.26 21.52 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.448 2.299 . . . . 10.0 113.994 -177.755 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.75 9.37 81.21 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 117.979 1.952 . . . . 10.0 117.979 145.433 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -96.53 139.27 32.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.723 1.762 . . . . 10.0 113.199 -174.387 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.8 152.13 11.41 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.862 2.065 . . . . 10.0 108.741 160.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.24 67.97 8.43 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.987 2.458 . . . . 10.0 111.325 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.76 4.26 51.99 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 116.338 1.295 . . . . 10.0 116.338 169.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -70.1 175.04 4.79 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 119.173 1.486 . . . . 10.0 111.466 166.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -152.71 137.48 17.03 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.849 -1.157 . . . . 10.0 112.101 -174.753 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -156.66 169.42 24.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.591 2.356 . . . . 10.0 111.032 -153.715 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.8 p -64.86 122.95 18.14 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.026 0.83 . . . . 10.0 112.333 -172.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -35.55 71.28 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.716 1.376 . . . . 10.0 114.716 -159.495 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.73 -27.89 68.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -179.107 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -58.31 -62.66 1.67 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.082 0.953 . . . . 10.0 111.339 -175.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.445 ' H ' ' HD3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -45.79 -54.88 7.3 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.869 1.667 . . . . 10.0 110.189 177.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -65.96 -30.62 71.22 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.327 1.851 . . . . 10.0 114.51 -177.022 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -22.4 66.26 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 117.237 -1.363 . . . . 10.0 113.493 -179.135 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.04 -10.95 2.17 Favored Glycine 0 CA--C 1.538 1.498 0 N-CA-C 118.011 1.964 . . . . 10.0 118.011 154.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -15.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 128.521 2.728 . . . . 10.0 115.653 -178.28 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.9 m 58.39 128.48 0.01 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 131.201 3.8 . . . . 10.0 113.932 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -69.34 123.15 20.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.182 -0.917 . . . . 10.0 111.058 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.96 176.53 9.31 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 127.247 2.219 . . . . 10.0 109.466 -177.313 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -47.24 -26.87 1.31 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.79 2.836 . . . . 10.0 114.771 178.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -74.26 -71.27 0.34 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 10.0 112.519 167.194 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 56.8 p -75.37 -36.03 61.02 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 128.544 2.737 . . . . 10.0 112.074 -158.478 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.68 -21.28 59.49 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.571 1.148 . . . . 10.0 111.504 175.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 18.5 ttm -64.47 -53.95 40.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.153 0.581 . . . . 10.0 109.51 168.487 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -63.22 -46.89 84.89 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.595 0.559 . . . . 10.0 110.681 178.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -65.9 -48.04 72.79 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 113.331 0.863 . . . . 10.0 113.331 -174.314 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -17.93 59.79 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.638 1.563 . . . . 10.0 114.122 175.331 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -72.46 -33.3 66.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.989 1.722 . . . . 10.0 113.696 164.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.74 110.5 0.95 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 120.164 1.347 . . . . 10.0 113.713 158.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.19 -44.01 0.48 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.753 1.635 . . . . 10.0 112.174 -167.607 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.1 mtmp? -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.74 2.416 . . . . 10.0 113.259 178.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -70.55 -54.6 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.294 1.438 . . . . 10.0 109.368 172.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -72.81 -32.15 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.777 1.029 . . . . 10.0 113.777 -166.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 14.6 pt -137.11 143.89 43.85 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.069 0.948 . . . . 10.0 110.656 173.194 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.64 74.47 5.44 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.372 2.714 . . . . 10.0 112.941 -165.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.13 -100.72 0.18 Allowed Glycine 0 CA--C 1.524 0.611 0 C-N-CA 124.43 1.014 . . . . 10.0 111.554 166.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.8 m 51.04 93.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.03 2.532 . . . . 10.0 115.737 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -64.55 16.07 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 128.125 2.57 . . . . 10.0 115.271 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.5 ttt -69.76 90.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.302 1.441 . . . . 10.0 111.143 -178.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 81' ' ' ILE . 1.9 mp -66.34 69.58 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.607 1.963 . . . . 10.0 111.591 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -163.73 -42.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.943 1.697 . . . . 10.0 111.806 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.32 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 120.89 3.663 . . . . 10.0 120.89 178.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -166.39 147.09 11.61 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 121.427 1.922 . . . . 10.0 111.345 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . 0.269 12.2 tt -71.23 -68.02 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 N-CA-C 115.19 1.552 . . . . 10.0 115.19 -165.221 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.3 tttm -176.85 -51.25 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.156 1.782 . . . . 10.0 112.487 -179.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.479 ' HE3' ' HB ' ' A' ' 89' ' ' THR . 28.3 ttpt -164.24 146.87 9.12 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.947 2.099 . . . . 10.0 107.628 -160.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -58.84 -32.33 69.32 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 -176.146 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.479 ' HB ' ' HE3' ' A' ' 87' ' ' LYS . 4.9 m -61.67 -34.02 75.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.172 0.804 . . . . 10.0 113.172 174.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -76.3 -37.14 57.89 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.587 0.63 . . . . 10.0 111.73 171.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -55.15 -45.47 75.67 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.911 -1.118 . . . . 10.0 111.679 172.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -56.1 -53.89 51.58 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.623 1.169 . . . . 10.0 111.673 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -60.21 -34.87 74.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.528 0.731 . . . . 10.0 112.804 -169.079 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.49 -44.72 90.1 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.162 -0.961 . . . . 10.0 112.99 172.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.65 -46.82 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 109.158 -0.682 . . . . 10.0 109.158 177.624 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.76 -55.58 32.37 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.782 0.833 . . . . 10.0 111.903 173.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -50.68 -60.82 2.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.353 1.861 . . . . 10.0 112.505 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.9 -20.21 58.21 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.365 1.246 . . . . 10.0 114.365 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.445 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.6 OUTLIER -67.32 -29.35 68.89 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.166 1.348 . . . . 10.0 112.271 168.324 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -69.76 -39.73 76.53 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 117.674 -1.155 . . . . 10.0 112.24 165.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.86 -9.0 2.48 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 116.22 1.933 . . . . 10.0 116.22 -178.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 22.7 p -94.59 7.36 45.95 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.96 1.304 . . . . 10.0 114.016 167.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -150.68 -15.42 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.322 1.449 . . . . 10.0 113.495 -163.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 C--O 1.255 1.367 0 C-N-CA 130.21 3.404 . . . . 10.0 107.964 179.716 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.498 HMD3 ' O ' ' A' ' 28' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 CA-C-O 119.71 -0.494 . . . . 10.0 112.356 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -86.94 103.13 15.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.221 1.408 . . . . 10.0 111.825 -163.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.7 m -60.54 -16.0 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 114.161 1.171 . . . . 10.0 114.161 -175.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -69.59 -59.6 2.86 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.873 2.069 . . . . 10.0 111.693 167.762 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -53.75 -27.79 30.69 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.842 0.857 . . . . 10.0 112.254 170.252 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.18 -47.76 12.46 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.699 1.142 . . . . 10.0 111.863 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 pttm -68.89 -39.9 79.51 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.397 1.099 . . . . 10.0 112.231 177.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.34 -40.6 81.5 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.739 -1.6 . . . . 10.0 111.504 178.285 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.5 -33.61 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 121.559 1.981 . . . . 10.0 111.062 173.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -57.18 -53.78 54.24 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 118.854 0.752 . . . . 10.0 110.425 170.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.52 -10.34 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 N-CA-C 113.677 0.992 . . . . 10.0 113.677 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -96.81 -38.28 9.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.66 1.984 . . . . 10.0 111.598 -176.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -125.66 -17.35 5.51 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 115.031 1.493 . . . . 10.0 115.031 -172.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.0 m -112.49 -39.88 4.25 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 125.07 1.348 . . . . 10.0 112.235 -172.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.07 -17.31 9.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.743 0.645 . . . . 10.0 112.743 170.208 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.36 -29.07 32.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.061 1.744 . . . . 10.0 113.052 166.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 96.7 m -145.34 11.3 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 126.52 1.928 . . . . 10.0 114.983 -177.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -149.38 -178.3 6.34 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.106 1.321 . . . . 10.0 111.385 -177.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -150.91 172.76 15.16 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.357 -1.464 . . . . 10.0 108.071 151.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -166.09 -41.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 125.623 1.569 . . . . 10.0 111.869 162.365 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.81 82.71 0.11 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.729 0.812 . . . . 10.0 109.181 172.081 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 56.41 -174.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.883 2.073 . . . . 10.0 111.206 -166.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.59 29.46 63.98 Favored Glycine 0 CA--C 1.54 1.613 0 N-CA-C 116.956 1.543 . . . . 10.0 116.956 170.373 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.22 127.4 38.93 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 119.15 1.475 . . . . 10.0 112.556 175.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -163.32 8.39 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.685 1.735 . . . . 10.0 115.685 -171.171 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 63.74 -70.35 0.07 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.201 3.001 . . . . 10.0 111.742 -177.93 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 43.02 97.57 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 130.485 3.514 . . . . 10.0 114.157 175.019 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.0 m 58.23 -17.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 127.782 2.433 . . . . 10.0 116.123 -169.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.09 -176.4 14.4 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 120.168 1.349 . . . . 10.0 113.842 174.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.39 -2.59 12.63 Favored 'Trans proline' 0 CA--C 1.536 0.585 1 C-N-CA 125.978 4.452 . . . . 10.0 115.885 -175.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.421 0.1 OUTLIER 43.56 158.0 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.847 2.859 . . . . 10.0 117.336 -154.818 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.38 24.42 1.16 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 119.749 -1.844 . . . . 10.0 113.875 -167.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.457 ' CD2' HE21 ' A' ' 42' ' ' GLN . 0.2 OUTLIER -57.28 98.96 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 130.001 3.32 . . . . 10.0 114.436 -166.334 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.53 7.72 61.55 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.468 1.033 . . . . 10.0 114.378 176.557 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.49 178.4 0.42 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.115 1.458 . . . . 10.0 110.569 168.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.25 18.0 m-85 63.69 26.2 14.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 10.0 113.939 -159.068 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 176.61 15.11 0.02 OUTLIER Glycine 0 CA--C 1.536 1.39 0 C-N-CA 126.141 1.829 . . . . 10.0 114.716 -175.731 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -153.15 160.26 42.83 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.074 1.437 . . . . 10.0 111.304 -168.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.5 pttm -81.05 160.1 24.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.609 1.564 . . . . 10.0 112.762 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 t -58.47 150.07 23.54 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.082 -0.386 . . . . 10.0 110.354 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.24 63.6 0.8 Allowed Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.261 0.934 . . . . 10.0 112.138 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.457 HE21 ' CD2' ' A' ' 33' ' ' HIS . 13.3 pt20 -154.21 -19.49 0.13 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -177.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 136.15 96.59 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 119.169 0.895 . . . . 10.0 112.163 -168.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.91 72.96 5.0 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.631 2.887 . . . . 10.0 113.074 -168.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.01 2.37 52.24 Favored Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.77 1.468 . . . . 10.0 116.77 165.171 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.64 155.16 34.22 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 119.178 1.489 . . . . 10.0 111.163 175.433 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 m -71.72 74.87 0.84 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.341 1.456 . . . . 10.0 113.42 -176.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -83.67 172.88 11.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.752 1.621 . . . . 10.0 111.935 166.2 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.9 p -77.3 172.98 12.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 121.254 -0.904 . . . . 10.0 111.526 167.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -69.23 -63.28 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.095 -1.003 . . . . 10.0 111.392 169.288 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.8 -39.46 65.49 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.899 1.28 . . . . 10.0 113.92 -160.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -61.86 -38.44 88.25 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.678 0.791 . . . . 10.0 112.942 178.335 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.487 ' HE3' ' HA ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -77.19 -51.28 11.23 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.528 1.931 . . . . 10.0 110.701 173.834 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.36 -30.91 71.79 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.069 2.147 . . . . 10.0 113.32 -174.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 mmmm -159.99 16.58 0.14 Allowed 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.135 0.974 . . . . 10.0 113.391 -153.343 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.63 -133.61 0.67 Allowed Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.335 0.969 . . . . 10.0 111.878 163.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.2 pp -170.23 -178.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.977 1.711 . . . . 10.0 110.521 -157.226 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 m -74.46 119.62 18.9 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.522 1.529 . . . . 10.0 111.194 172.437 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -77.14 62.07 2.16 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.461 1.504 . . . . 10.0 110.991 169.205 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -78.27 0.18 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 131.321 3.848 . . . . 10.0 115.643 -172.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 179.46 -9.56 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.992 2.917 . . . . 10.0 114.415 -176.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -81.82 -64.63 1.14 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.519 1.963 . . . . 10.0 112.857 160.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.8 p -54.74 -35.79 64.11 Favored 'General case' 0 N--CA 1.467 0.388 1 C-N-CA 132.078 4.151 . . . . 10.0 114.913 -165.613 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.6 mp -69.99 -24.56 63.33 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 117.606 -1.187 . . . . 10.0 113.103 175.327 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -41.91 68.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 120.55 1.523 . . . . 10.0 109.425 175.741 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -46.61 78.33 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.418 -0.513 . . . . 10.0 110.336 172.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -67.64 -43.6 79.93 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.711 1.004 . . . . 10.0 113.711 -174.712 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.35 -34.36 74.47 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.884 1.675 . . . . 10.0 112.572 177.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -76.36 -25.77 55.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.494 0.718 . . . . 10.0 112.694 177.147 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.58 74.63 2.11 Favored Pre-proline 0 CA--C 1.559 1.296 0 N-CA-C 113.275 0.842 . . . . 10.0 113.275 -178.25 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.29 -50.13 1.08 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.887 2.391 . . . . 10.0 112.487 -166.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -66.85 -22.26 65.99 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.798 1.639 . . . . 10.0 113.689 -178.747 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -75.41 -53.33 8.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.327 1.051 . . . . 10.0 110.274 166.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.34 -38.46 91.22 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.465 0.913 . . . . 10.0 113.465 -172.601 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 6.0 pt -131.69 117.72 16.48 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.773 0.829 . . . . 10.0 110.767 171.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.19 104.37 1.66 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.574 2.85 . . . . 10.0 111.798 -172.1 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.68 82.31 1.62 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.032 0.825 . . . . 10.0 111.594 178.189 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -133.22 -19.38 2.2 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.253 1.946 . . . . 10.0 116.253 -169.812 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 55.47 2.29 0.06 Allowed 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 117.039 2.236 . . . . 10.0 117.039 173.461 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.2 ttt -62.93 81.45 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 120.302 1.41 . . . . 10.0 110.081 161.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.49 90.26 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.956 1.303 . . . . 10.0 109.359 176.063 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -161.6 -68.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 118.32 -0.848 . . . . 10.0 112.825 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.17 89.08 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 127.237 2.215 . . . . 10.0 116.527 172.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.38 92.56 2.05 Favored Glycine 0 CA--C 1.532 1.101 0 O-C-N 121.691 -0.631 . . . . 10.0 113.179 175.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 17.8 tt -64.38 -36.82 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 115.808 1.781 . . . . 10.0 115.808 -167.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttm 164.41 -165.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 129.413 3.085 . . . . 10.0 108.501 -161.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.51 ' HE2' ' HG2' ' A' ' 90' ' ' GLU . 40.8 pttt -52.63 153.32 3.19 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.973 1.709 . . . . 10.0 110.91 167.088 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -73.16 71.45 1.16 Allowed 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 123.325 1.536 . . . . 10.0 110.774 171.656 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.3 m -151.89 -54.34 0.13 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 125.903 1.681 . . . . 10.0 108.259 169.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG2' ' HE2' ' A' ' 87' ' ' LYS . 18.6 mm-40 -56.7 -38.83 72.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.762 0.71 . . . . 10.0 111.313 172.47 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -30.98 71.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.153 0.581 . . . . 10.0 111.907 174.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.05 -36.08 61.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.068 0.947 . . . . 10.0 111.239 173.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -66.59 -48.08 70.69 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.646 1.978 . . . . 10.0 111.186 175.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.23 -53.91 30.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.949 2.1 . . . . 10.0 112.668 174.681 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.0 mm -64.26 -38.88 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 122.781 0.432 . . . . 10.0 110.274 -178.763 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.7 99.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 122.525 0.33 . . . . 10.0 111.647 173.375 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.401 ' CD2' ' HG ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -56.6 -60.85 2.93 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.476 1.11 . . . . 10.0 111.195 172.287 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 97' ' ' TYR . 60.2 mt -61.04 -36.78 80.48 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.543 1.065 . . . . 10.0 112.728 -175.626 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.91 -32.57 61.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 117.891 -1.052 . . . . 10.0 112.721 174.478 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -101.13 -35.79 9.19 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 175.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.61 -27.53 64.77 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.969 1.713 . . . . 10.0 113.506 -178.262 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.9 t -65.38 -11.65 44.4 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.835 1.254 . . . . 10.0 114.363 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.71 51.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.031 2.132 . . . . 10.0 111.029 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 113.388 0.885 . . . . 10.0 113.388 172.026 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.123 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.29 119.88 19.25 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.814 1.246 . . . . 10.0 110.501 -161.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.472 HG23 ' HA ' ' A' ' 97' ' ' TYR . 7.3 p -56.24 -34.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 O-C-N 121.48 -0.763 . . . . 10.0 111.294 172.482 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.2 mp0 -60.72 -48.02 83.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 126.528 1.931 . . . . 10.0 111.164 -171.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mtmp? -75.68 -23.64 56.23 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.069 1.748 . . . . 10.0 113.568 167.579 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.27 -46.42 7.54 Favored Glycine 0 N--CA 1.464 0.555 0 O-C-N 121.236 -0.915 . . . . 10.0 111.78 -168.54 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -41.48 50.79 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.923 1.289 . . . . 10.0 113.408 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -71.72 -37.86 70.57 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.709 -1.139 . . . . 10.0 113.763 179.228 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.27 -35.61 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 120.372 1.442 . . . . 10.0 109.996 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.436 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 32.6 t80 -57.08 -51.11 70.61 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.222 0.919 . . . . 10.0 110.624 173.606 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.22 -16.63 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 113.968 1.099 . . . . 10.0 113.968 177.033 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.2 -34.76 25.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.535 1.134 . . . . 10.0 111.953 -173.768 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -136.53 -58.95 0.73 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.799 1.639 . . . . 10.0 110.334 -163.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 8.9 m -58.45 -45.9 87.64 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.806 1.243 . . . . 10.0 111.999 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -8.78 17.88 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.713 1.375 . . . . 10.0 114.713 175.497 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -10.22 59.48 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.01 -1.056 . . . . 10.0 112.412 169.774 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 87.3 m -142.87 -27.55 0.58 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -173.024 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -116.72 168.12 10.48 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.333 2.253 . . . . 10.0 112.956 -176.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -136.07 137.78 41.45 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.859 1.263 . . . . 10.0 109.855 165.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.2 p -166.26 -32.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.923 1.289 . . . . 10.0 111.738 172.364 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -48.21 -38.06 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.36 2.264 . . . . 10.0 115.311 175.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.46 148.47 16.38 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.489 1.916 . . . . 10.0 108.14 168.346 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 -143.21 48.35 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-O 121.583 0.546 . . . . 10.0 112.05 -172.336 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.5 118.21 0.53 Allowed Glycine 0 CA--C 1.527 0.806 0 C-N-CA 125.084 1.326 . . . . 10.0 111.575 -176.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -164.33 167.78 19.41 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.376 2.27 . . . . 10.0 109.008 178.786 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.89 148.94 28.4 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 121.349 -0.844 . . . . 10.0 111.689 -173.767 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -143.91 -34.82 0.38 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.119 1.768 . . . . 10.0 113.399 -174.172 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.422 ' O ' HMD3 ' A' ' 105' ' ' HEC . 1.4 m -150.9 -21.17 0.22 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.433 0.693 . . . . 10.0 111.604 -169.032 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -131.97 167.06 22.97 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 109.782 -1.327 . . . . 10.0 109.782 149.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.0 155.49 52.78 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 10.0 112.135 179.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.69 129.68 40.73 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.068 -1.02 . . . . 10.0 109.82 165.543 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.32 70.36 2.92 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.571 1.653 . . . . 10.0 112.592 -167.311 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.65 88.61 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.583 1 C-N-CA 132.576 4.35 . . . . 10.0 115.112 -178.931 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.58 27.23 70.62 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.245 0.926 . . . . 10.0 114.938 162.652 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.5 mp -53.37 166.06 0.31 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.834 1.654 . . . . 10.0 111.905 178.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HA ' ' A' ' 60' ' ' LYS . 29.1 m-85 65.36 59.37 0.8 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.007 1.723 . . . . 10.0 113.246 -174.067 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 161.35 -46.01 0.38 Allowed Glycine 0 CA--C 1.53 0.986 0 CA-C-N 115.533 -0.758 . . . . 10.0 114.187 167.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.11 169.51 13.06 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.976 0.91 . . . . 10.0 112.13 177.086 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.1 pttm -74.74 -20.52 59.79 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 115.055 1.502 . . . . 10.0 115.055 -165.828 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.453 HG21 ' H ' ' A' ' 59' ' ' TRP 0.288 29.6 p 88.05 167.5 0.06 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 129.417 3.087 . . . . 10.0 112.659 175.449 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 70.21 116.77 0.04 OUTLIER Glycine 0 CA--C 1.541 1.664 0 C-N-CA 123.109 0.385 . . . . 10.0 112.217 -154.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -159.45 4.87 0.09 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.393 1.877 . . . . 10.0 113.861 168.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -50.86 108.98 1.16 Allowed Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 125.966 1.707 . . . . 10.0 114.651 -164.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.6 65.61 8.09 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.386 3.391 . . . . 10.0 112.944 -171.459 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 107.64 60.26 0.56 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.798 1.19 . . . . 10.0 113.171 174.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -143.81 169.66 17.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.182 1.393 . . . . 10.0 109.607 177.286 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -153.25 151.79 30.44 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.585 0.754 . . . . 10.0 110.772 177.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.402 ' CD2' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -157.76 -92.89 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 10.0 111.22 -153.899 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -145.8 -1.64 0.77 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.129 2.172 . . . . 10.0 114.106 -177.006 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 45.46 -95.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.923 2.089 . . . . 10.0 112.613 -157.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 30.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.697 3.199 . . . . 10.0 115.558 170.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -43.95 -56.61 3.82 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.782 2.033 . . . . 10.0 111.695 174.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.402 ' HE3' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -62.01 -40.09 94.49 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.263 1.825 . . . . 10.0 111.087 -177.397 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -63.41 -48.6 77.13 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.227 1.411 . . . . 10.0 111.533 176.259 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -62.18 -24.09 66.99 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.714 1.206 . . . . 10.0 113.701 -174.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.4 36.66 93.68 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.375 0.989 . . . . 10.0 114.184 171.083 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -1.44 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.869 2.067 . . . . 10.0 116.084 -174.486 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.8 m 56.27 92.59 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.606 1.963 . . . . 10.0 113.184 -179.689 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.632 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 10.5 m95 -58.68 125.75 24.75 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.427 168.954 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.424 ' HA ' ' CD2' ' A' ' 36' ' ' PHE . 0.6 OUTLIER -162.76 178.62 8.31 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.782 2.833 . . . . 10.0 109.177 -178.237 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -67.17 35.36 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 129.637 3.175 . . . . 10.0 114.574 -172.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -160.89 -63.8 0.06 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 127.904 2.482 . . . . 10.0 108.432 -174.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 72.5 p -57.92 -46.93 84.25 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.116 1.366 . . . . 10.0 111.673 179.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.44 -29.09 66.72 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.563 1.145 . . . . 10.0 111.783 175.519 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 30.3 ttm -68.77 -43.69 75.24 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 118.275 0.489 . . . . 10.0 111.105 175.663 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -67.91 -45.79 73.37 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 117.908 0.322 . . . . 10.0 110.184 173.305 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.5 -57.72 11.53 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 118.107 -0.949 . . . . 10.0 112.45 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -34.05 76.72 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.549 1.522 . . . . 10.0 111.904 -174.573 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -73.02 -22.05 60.72 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.634 1.716 . . . . 10.0 115.634 175.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -161.47 63.15 1.61 Allowed Pre-proline 0 CA--C 1.556 1.189 0 CA-C-N 120.156 1.344 . . . . 10.0 114.384 178.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.208 1.939 . . . . 10.0 113.072 -159.18 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -71.17 -20.47 62.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.703 2.001 . . . . 10.0 112.745 -178.248 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.23 -51.99 10.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.521 1.129 . . . . 10.0 110.231 164.149 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -60.49 -44.99 95.37 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.87 1.063 . . . . 10.0 113.87 -173.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 pt -137.08 124.35 14.07 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.992 . . . . 10.0 110.436 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -78.07 60.24 7.28 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.407 3.405 . . . . 10.0 112.696 -167.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.85 66.38 0.04 OUTLIER Glycine 0 CA--C 1.523 0.584 0 O-C-N 121.567 -0.708 . . . . 10.0 113.338 179.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 4.5 m -135.91 125.35 25.0 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.886 0.874 . . . . 10.0 111.871 173.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -86.39 -3.53 59.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.783 1.401 . . . . 10.0 114.783 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 16.1 ttt -50.11 101.83 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.972 1.709 . . . . 10.0 113.7 -174.816 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 27.3 mm -78.22 72.96 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.224 1.41 . . . . 10.0 109.583 175.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -163.58 -49.42 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.851 1.26 . . . . 10.0 111.139 169.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 45.93 32.53 1.35 Allowed 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 118.081 2.623 . . . . 10.0 118.081 164.52 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 179.0 -161.11 27.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.965 1.269 . . . . 10.0 111.441 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.2 tt -147.68 -175.37 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.554 0.742 . . . . 10.0 111.71 165.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -77.89 -30.47 50.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.939 1.296 . . . . 10.0 114.492 -164.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -161.63 -68.96 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 116.588 -1.672 . . . . 10.0 111.755 -170.069 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 pttm 174.98 -40.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.777 2.031 . . . . 10.0 115.815 164.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 m -58.39 -30.3 66.71 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.732 1.606 . . . . 10.0 112.04 -178.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 1.3 mp0 -59.42 -29.08 67.5 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.23 -0.919 . . . . 10.0 112.366 173.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -67.13 -55.57 13.66 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 119.189 0.904 . . . . 10.0 111.63 -178.476 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -61.06 -34.67 75.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.933 1.293 . . . . 10.0 111.618 175.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -67.33 -45.9 75.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.145 0.884 . . . . 10.0 112.545 174.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.483 HD23 HMB1 ' A' ' 105' ' ' HEC . 7.5 mp -65.14 -38.36 90.36 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.334 -0.854 . . . . 10.0 113.019 174.744 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.6 mt -61.16 -51.21 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 118.566 -0.73 . . . . 10.0 109.6 170.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.39 -41.64 85.31 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.876 0.762 . . . . 10.0 112.557 177.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.472 ' HA ' HG23 ' A' ' 3' ' ' VAL . 2.7 t80 -50.36 -65.73 0.51 Allowed 'General case' 0 C--N 1.341 0.228 0 C-N-CA 124.407 1.083 . . . . 10.0 111.557 169.414 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.4 -36.01 82.3 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.491 0.587 . . . . 10.0 112.131 -175.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -65.75 -21.61 66.53 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.423 1.489 . . . . 10.0 114.263 176.029 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -87.79 -52.56 5.23 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.466 1.03 . . . . 10.0 111.422 160.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -26.05 52.97 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.054 1.501 . . . . 10.0 115.054 -170.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.556 HG23 HD22 ' A' ' 103' ' ' ASN . 4.5 t -74.11 -1.86 22.03 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.42 1.488 . . . . 10.0 114.126 172.674 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.556 HD22 HG23 ' A' ' 102' ' ' THR . 7.1 p30 -154.08 -18.61 0.13 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 117.12 2.267 . . . . 10.0 117.12 -178.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.074 -1.917 . . . . 10.0 114.561 177.952 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.632 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 CA-C-O 118.828 -0.984 . . . . 10.0 111.347 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -140.74 160.12 40.73 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.287 1.588 . . . . 10.0 115.287 -149.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 1.1 p -60.17 -53.0 54.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 125.817 1.647 . . . . 10.0 112.749 -179.22 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -44.45 97.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.786 1.176 . . . . 10.0 113.335 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -56.13 -36.22 68.0 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.675 0.75 . . . . 10.0 110.793 172.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.37 -51.42 6.7 Favored Glycine 0 C--O 1.224 -0.512 0 C-N-CA 125.248 1.404 . . . . 10.0 110.288 -173.724 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -37.52 83.38 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.111 1.456 . . . . 10.0 112.637 177.248 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -59.94 -56.79 17.33 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.625 0.77 . . . . 10.0 111.594 174.724 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -31.76 47.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 118.438 0.563 . . . . 10.0 111.816 -178.45 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -56.41 -51.08 69.69 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.371 -1.455 . . . . 10.0 110.576 168.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.68 -15.53 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 113.682 0.993 . . . . 10.0 113.682 178.375 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -90.09 -43.6 10.38 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.025 1.33 . . . . 10.0 111.78 -179.631 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -119.2 -11.37 9.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.932 1.456 . . . . 10.0 114.932 -169.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -120.32 -44.17 2.49 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.451 1.5 . . . . 10.0 111.434 -172.345 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.31 -11.17 20.03 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.696 0.998 . . . . 10.0 113.696 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.25 -25.95 26.18 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.953 2.101 . . . . 10.0 112.553 164.04 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.8 m -141.68 -19.29 0.75 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 10.0 113.629 -173.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.43 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 92.3 m-70 -130.25 86.16 2.37 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 10.0 110.897 -177.067 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.2 p -69.69 18.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.574 2.064 . . . . 10.0 116.574 -167.467 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.71 -35.07 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 O-C-N 120.642 -1.286 . . . . 10.0 113.509 -160.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -62.99 -0.84 0.76 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 126.131 1.772 . . . . 10.0 114.271 177.077 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -150.28 13.68 0.77 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.109 2.164 . . . . 10.0 111.561 178.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.13 -73.18 0.13 Allowed Glycine 0 CA--C 1.532 1.126 0 C-N-CA 125.137 1.351 . . . . 10.0 112.312 -169.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.37 -119.17 8.72 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 126.545 2.022 . . . . 10.0 112.442 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.93 165.87 22.25 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.728 2.011 . . . . 10.0 110.454 169.306 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -64.9 81.05 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.746 1.219 . . . . 10.0 112.665 178.467 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -68.86 -31.1 69.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.53 1.532 . . . . 10.0 112.512 179.67 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.8 m -155.07 -23.75 0.12 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.254 -0.879 . . . . 10.0 113.248 172.589 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.43 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -124.98 170.99 16.95 Favored Glycine 0 CA--C 1.54 1.653 0 CA-C-N 119.657 1.117 . . . . 10.0 111.95 167.125 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.24 44.18 1.6 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 124.908 3.739 . . . . 10.0 113.969 -153.197 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 48.14 18.84 0.16 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.172 2.189 . . . . 10.0 115.963 -178.378 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt 33.37 64.6 0.3 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.964 2.905 . . . . 10.0 112.835 -179.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -54.11 80.48 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.83 2.452 . . . . 10.0 111.748 172.098 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.04 -47.89 0.07 OUTLIER Glycine 0 CA--C 1.536 1.358 0 C-N-CA 129.827 3.584 . . . . 10.0 116.237 -179.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.51 ' CD2' HMA3 ' A' ' 105' ' ' HEC 0.276 8.6 mp 53.78 -148.8 0.44 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.533 1.933 . . . . 10.0 110.295 -165.67 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 34.8 59.52 0.68 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.148 2.179 . . . . 10.0 114.959 178.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 115.81 -27.2 8.43 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.693 2.092 . . . . 10.0 113.17 -174.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -69.49 74.26 0.38 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.071 1.348 . . . . 10.0 111.344 170.087 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt 34.03 -125.25 0.09 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 129.927 3.291 . . . . 10.0 113.776 161.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.41 HG22 ' HA ' ' A' ' 53' ' ' LYS . 3.7 m -149.52 -79.62 0.13 Allowed 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.163 -1.585 . . . . 10.0 109.742 171.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.59 88.47 0.73 Allowed Glycine 0 CA--C 1.535 1.296 0 O-C-N 120.357 -1.464 . . . . 10.0 115.541 179.816 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -134.4 9.53 3.72 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.452 1.279 . . . . 10.0 114.452 -178.085 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.8 140.34 93.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 121.031 -1.043 . . . . 10.0 112.266 -176.735 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -77.61 52.34 3.91 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 124.104 3.203 . . . . 10.0 112.876 -177.382 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.88 -96.49 0.37 Allowed Glycine 0 CA--C 1.527 0.785 0 C-N-CA 126.347 1.927 . . . . 10.0 110.869 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.7 t80 32.8 100.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 128.758 2.823 . . . . 10.0 117.234 165.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 m -66.33 90.25 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.168 -0.957 . . . . 10.0 112.258 168.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -83.13 174.0 11.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.298 1.439 . . . . 10.0 110.447 161.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.0 p -74.42 30.88 0.08 Allowed 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.061 1.504 . . . . 10.0 115.061 -174.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.5 t70 45.73 -69.02 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 129.849 3.259 . . . . 10.0 115.593 -166.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.04 -45.73 61.4 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.026 1.73 . . . . 10.0 113.552 -150.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -45.9 -70.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.38 1.472 . . . . 10.0 111.748 171.323 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HZ3' ' CGA' ' A' ' 105' ' ' HEC . 18.9 mtpp -71.19 -25.37 62.49 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.581 1.552 . . . . 10.0 112.447 -171.197 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.56 -45.93 92.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.51 1.524 . . . . 10.0 112.697 161.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.71 -24.13 65.35 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.27 0.941 . . . . 10.0 113.184 -170.198 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.77 26.9 70.19 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-O 119.1 -0.833 . . . . 10.0 115.072 163.46 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -3.96 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 115.847 1.795 . . . . 10.0 115.847 -171.615 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.4 m 57.86 108.9 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.565 2.346 . . . . 10.0 114.002 -170.551 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.413 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 25.1 m95 -67.24 119.76 12.67 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.284 -0.871 . . . . 10.0 112.349 173.067 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -166.63 -175.92 3.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.742 2.817 . . . . 10.0 108.768 175.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -45.59 -53.08 9.63 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.645 1.578 . . . . 10.0 111.635 176.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.67 15.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.862 2.065 . . . . 10.0 116.047 -174.833 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.9 p -157.73 -39.26 0.07 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.94 -1.1 . . . . 10.0 110.879 -169.221 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -30.19 59.65 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.181 1.355 . . . . 10.0 112.787 174.841 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -51.03 58.46 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 119.613 1.097 . . . . 10.0 108.616 174.743 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.81 -37.74 87.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.506 0.722 . . . . 10.0 110.653 -179.807 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -66.06 -65.38 0.68 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.403 -0.808 . . . . 10.0 112.561 173.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -17.26 64.71 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.818 1.645 . . . . 10.0 114.301 -172.756 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.93 -32.05 71.38 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.806 1.185 . . . . 10.0 113.557 165.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -163.23 79.31 1.67 Allowed Pre-proline 0 CA--C 1.549 0.933 0 CA-C-N 119.754 1.161 . . . . 10.0 111.642 177.262 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.36 -52.25 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.189 1.926 . . . . 10.0 110.873 -163.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -67.78 24.88 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.767 2.827 . . . . 10.0 114.568 -177.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.91 -28.8 0.06 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.921 2.089 . . . . 10.0 111.894 -175.081 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -64.62 -38.6 91.56 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 119.273 0.942 . . . . 10.0 112.006 165.376 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.4 pt -133.78 151.08 76.34 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 124.239 1.016 . . . . 10.0 111.381 176.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.1 162.2 41.36 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.725 2.284 . . . . 10.0 111.213 173.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 39.7 61.85 1.51 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.955 1.74 . . . . 10.0 114.775 172.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.9 t -121.08 -14.41 8.41 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.101 1.519 . . . . 10.0 115.101 178.198 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? 54.5 -67.14 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 127.668 2.387 . . . . 10.0 116.071 179.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 20.1 ttt 13.53 85.17 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 130.961 3.704 . . . . 10.0 113.838 -177.15 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -70.53 80.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.856 1.263 . . . . 10.0 109.553 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -162.95 -51.83 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.455 1.502 . . . . 10.0 111.19 172.086 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 35.15 57.6 0.79 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.845 2.458 . . . . 10.0 116.449 170.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 161.41 -166.96 36.11 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.457 1.027 . . . . 10.0 111.594 179.446 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 tt -158.08 178.15 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.826 1.65 . . . . 10.0 109.475 166.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -88.9 166.96 13.61 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.844 1.202 . . . . 10.0 111.047 178.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . 0.258 8.6 ptpp? 40.21 -103.53 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.602 1.961 . . . . 10.0 112.153 -172.522 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.2 tttp -163.17 -32.95 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.828 1.251 . . . . 10.0 112.578 154.003 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.9 m -59.06 -21.39 59.09 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.78 1.4 . . . . 10.0 114.78 -178.882 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -54.64 -32.77 59.57 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.067 -1.021 . . . . 10.0 112.354 167.444 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.35 -22.36 61.17 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.226 1.411 . . . . 10.0 112.744 175.423 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.26 -53.91 7.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.238 1.015 . . . . 10.0 110.402 164.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.65 1.58 . . . . 10.0 111.735 -169.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 mp -53.69 -42.95 68.52 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 114.499 1.296 . . . . 10.0 114.499 173.668 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.8 mm -66.09 -50.86 66.06 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.238 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.132 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.42 66.28 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.916 -1.04 . . . . 10.0 113.301 179.471 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -66.51 -69.2 0.32 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.67 1.988 . . . . 10.0 112.557 159.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.79 -20.6 63.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.085 0.772 . . . . 10.0 113.085 -173.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.17 -35.52 62.4 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.883 2.073 . . . . 10.0 113.371 166.815 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -81.27 -46.0 15.42 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.037 1.335 . . . . 10.0 110.874 171.399 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.2 -1.02 0.27 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.453 2.39 . . . . 10.0 117.453 -166.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.7 t -133.85 15.42 3.94 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.838 1.255 . . . . 10.0 114.227 168.4 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -151.02 -13.48 0.22 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.767 1.627 . . . . 10.0 114.172 -169.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.949 1.699 . . . . 10.0 114.25 177.214 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.51 HMA3 ' CD2' ' A' ' 35' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.942 0 CA-C-O 117.914 -1.492 . . . . 10.0 111.792 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -139.53 164.59 29.48 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.119 1.459 . . . . 10.0 114.823 -173.601 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.4 t -75.29 -61.22 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 126.281 1.832 . . . . 10.0 109.879 165.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -60.0 -47.36 86.14 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.986 -1.071 . . . . 10.0 113.531 -175.236 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -59.16 -31.47 69.01 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 117.871 0.305 . . . . 10.0 111.226 172.918 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.23 -50.94 19.82 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 125.858 1.694 . . . . 10.0 111.379 178.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -32.7 74.36 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 117.879 0.84 . . . . 10.0 111.813 -179.337 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -63.26 -55.2 26.84 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.802 1.241 . . . . 10.0 111.413 173.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.251 0.2 OUTLIER -68.3 -30.17 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 CA-C-N 118.473 0.579 . . . . 10.0 111.747 -179.474 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -56.35 -54.06 49.93 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 120.468 -1.395 . . . . 10.0 110.83 164.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.2 t -62.23 -13.93 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 O-C-N 121.308 -0.87 . . . . 10.0 113.209 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -91.93 -42.16 10.19 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.641 1.177 . . . . 10.0 112.285 178.508 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -124.44 -3.06 7.93 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.63 1.715 . . . . 10.0 115.63 -168.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.7 m -120.67 -43.9 2.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.909 1.684 . . . . 10.0 111.0 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.64 -4.37 8.62 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.493 1.294 . . . . 10.0 114.493 176.304 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.47 -12.38 60.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.64 1.176 . . . . 10.0 113.964 164.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.63 -40.57 0.29 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.622 1.569 . . . . 10.0 112.49 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.468 ' CE1' ' HA3' ' A' ' 29' ' ' GLY . 84.5 m-70 -93.68 -161.61 0.86 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 127.504 2.322 . . . . 10.0 109.034 166.246 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.5 m -154.8 -55.07 0.1 Allowed 'General case' 0 N--CA 1.482 1.175 0 O-C-N 119.847 -1.783 . . . . 10.0 112.574 165.281 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t 61.2 -71.75 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 126.085 1.754 . . . . 10.0 114.422 177.568 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.35 -52.75 64.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.342 1.057 . . . . 10.0 111.769 -166.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -153.17 100.27 2.45 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.953 1.301 . . . . 10.0 110.582 -171.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.79 -7.73 8.25 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 117.003 1.561 . . . . 10.0 117.003 165.505 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.95 7.03 21.05 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.765 1.782 . . . . 10.0 117.33 169.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -75.0 75.36 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.633 2.373 . . . . 10.0 113.706 -164.146 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -64.27 62.17 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 128.551 2.74 . . . . 10.0 113.647 172.848 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.04 -21.0 65.94 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.321 -1.487 . . . . 10.0 113.667 176.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -154.4 -1.03 0.19 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.665 1.121 . . . . 10.0 114.019 174.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.468 ' HA3' ' CE1' ' A' ' 18' ' ' HIS . . . -148.89 156.61 26.92 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-N 120.681 1.582 . . . . 10.0 112.328 167.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.99 3.91 3.6 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 124.79 3.66 . . . . 10.0 117.088 -151.04 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 64.32 149.12 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.482 2.713 . . . . 10.0 112.654 -144.646 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 mp -83.54 50.0 1.7 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.647 1.179 . . . . 10.0 110.691 176.135 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.46 98.45 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 128.267 2.627 . . . . 10.0 113.821 -173.92 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 17.96 68.02 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.562 1.077 . . . . 10.0 114.651 173.894 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -61.06 172.28 1.05 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 118.914 1.357 . . . . 10.0 112.015 179.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.281 77.5 m-85 71.38 68.25 0.16 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.395 1.878 . . . . 10.0 111.614 -163.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 128.2 -23.45 5.19 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 126.731 2.11 . . . . 10.0 113.215 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.2 mtp85 -77.68 162.51 26.95 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.401 1.096 . . . . 10.0 112.557 173.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HD2' ' H ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -73.75 179.02 4.42 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.459 2.304 . . . . 10.0 111.765 171.74 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.3 p -73.82 174.87 7.86 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.295 1.038 . . . . 10.0 109.439 161.294 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.39 -179.37 37.52 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-O 121.788 0.66 . . . . 10.0 111.717 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 65.32 166.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.563 1.945 . . . . 10.0 114.696 -176.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 162.36 167.38 0.05 OUTLIER Pre-proline 0 CA--C 1.546 0.824 1 C-N-CA 133.216 4.607 . . . . 10.0 105.212 -169.222 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.77 -143.36 0.02 OUTLIER 'Trans proline' 0 CA--C 1.55 1.318 0 C-N-CA 122.538 2.159 . . . . 10.0 108.927 146.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.88 18.94 0.17 Allowed Glycine 0 CA--C 1.544 1.862 0 N-CA-C 117.447 1.739 . . . . 10.0 117.447 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -77.35 106.06 8.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.443 1.622 . . . . 10.0 110.893 175.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 m -65.61 138.64 58.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.13 1.372 . . . . 10.0 111.567 173.435 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.452 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.46 -178.94 6.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.519 1.528 . . . . 10.0 112.3 -175.126 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.3 p -71.78 164.35 26.15 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.203 0.601 . . . . 10.0 111.805 167.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -75.48 -111.24 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.236 -0.915 . . . . 10.0 109.847 163.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 35.81 -87.34 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 130.086 3.354 . . . . 10.0 115.051 168.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -45.82 -56.97 4.7 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.209 1.403 . . . . 10.0 112.738 170.428 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HE2' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -63.5 -35.78 81.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.227 0.611 . . . . 10.0 111.27 -175.71 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.21 -43.76 85.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.643 2.377 . . . . 10.0 113.417 172.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -21.94 55.09 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.851 1.797 . . . . 10.0 115.851 -167.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.06 -7.54 63.08 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 116.24 1.256 . . . . 10.0 116.24 159.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.6 pp -56.77 141.71 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 118.61 1.205 . . . . 10.0 111.966 -177.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.8 m -67.83 117.9 10.34 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 121.641 -0.662 . . . . 10.0 110.013 -178.288 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -71.18 113.55 8.33 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 170.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.62 179.52 7.14 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 10.0 111.887 -168.642 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -69.74 42.91 0.05 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.279 1.831 . . . . 10.0 115.207 -172.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -160.23 -66.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.132 2.173 . . . . 10.0 108.254 -176.372 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.0 p -57.22 -38.24 73.45 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 126.594 1.958 . . . . 10.0 112.731 -179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.57 -23.25 56.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 10.0 113.035 176.772 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -51.91 30.63 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.151 1.341 . . . . 10.0 108.466 169.454 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.2 -43.72 98.43 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 123.431 0.457 . . . . 10.0 110.315 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.61 -57.88 10.83 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 118.304 -0.855 . . . . 10.0 111.931 175.298 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.76 -28.79 67.11 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 120.288 1.404 . . . . 10.0 113.645 -172.114 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -78.88 -19.58 51.58 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.521 1.304 . . . . 10.0 114.521 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.4 60.73 1.43 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.37 1.068 . . . . 10.0 110.856 -167.681 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -67.95 -58.85 0.12 Allowed 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.519 2.146 . . . . 10.0 111.343 -168.142 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -70.63 38.2 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 129.034 2.934 . . . . 10.0 113.174 179.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.07 -49.52 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 128.391 2.676 . . . . 10.0 108.828 -169.391 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -62.18 -36.78 82.92 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.907 0.321 . . . . 10.0 111.539 174.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.82 154.59 73.01 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 126.163 1.785 . . . . 10.0 108.72 166.122 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.43 164.81 34.52 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 121.65 1.566 . . . . 10.0 110.425 165.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.32 66.84 2.33 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.184 -0.787 . . . . 10.0 114.208 168.356 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.2 m -129.49 -33.26 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.786 1.773 . . . . 10.0 115.786 172.68 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.8 mptt 62.78 -63.26 0.11 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 116.954 -1.498 . . . . 10.0 113.889 -170.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.1 ttt 10.27 91.29 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 129.715 3.206 . . . . 10.0 114.512 -173.098 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 19.9 mm -72.51 74.2 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 125.376 1.47 . . . . 10.0 110.895 -175.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -163.29 -49.46 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.615 1.566 . . . . 10.0 112.101 169.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.83 78.62 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.717 2.407 . . . . 10.0 115.576 172.876 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.62 -159.48 25.86 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.206 1.384 . . . . 10.0 112.916 -176.675 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.9 tt -153.84 -178.66 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.376 1.47 . . . . 10.0 109.812 157.046 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -76.36 -87.2 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.804 1.242 . . . . 10.0 114.003 -166.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -65.74 0.9 Allowed 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 120.669 1.577 . . . . 10.0 111.342 -176.107 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.6 pttt 174.57 -61.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 127.905 2.482 . . . . 10.0 111.721 176.574 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.4 m -59.46 -20.72 57.36 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.12 1.156 . . . . 10.0 114.12 -173.209 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -56.3 -26.99 54.06 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.081 0.855 . . . . 10.0 112.529 168.485 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -50.07 75.21 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 125.025 1.33 . . . . 10.0 110.898 172.285 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -62.72 -48.36 79.58 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.052 1.341 . . . . 10.0 110.222 176.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -59.88 -48.62 80.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.516 1.126 . . . . 10.0 111.773 -172.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mp -54.99 -49.64 70.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.19 0.811 . . . . 10.0 113.19 173.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.2 mm -62.67 -45.76 98.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 123.264 0.625 . . . . 10.0 109.69 -178.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.88 -46.86 86.84 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.817 1.247 . . . . 10.0 112.236 174.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.12 -59.95 4.19 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.875 0.87 . . . . 10.0 111.273 173.988 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.24 -37.95 89.3 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -173.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -62.06 -24.45 67.1 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.04 0.936 . . . . 10.0 112.852 176.956 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.51 -59.06 2.49 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.517 1.527 . . . . 10.0 111.896 165.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.61 -32.52 63.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.63 1.572 . . . . 10.0 114.588 -171.361 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -54.61 -32.27 58.52 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 174.845 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -87.93 -20.3 26.11 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.171 1.388 . . . . 10.0 114.372 177.957 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 116.128 -1.892 . . . . 10.0 112.939 -140.714 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.428 ' CGD' ' HE3' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 110.063 -1.215 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.503 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.7 OUTLIER -134.03 96.17 3.58 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.231 1.413 . . . . 10.0 107.447 -152.579 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.9 p -49.49 -39.02 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.679 1.592 . . . . 10.0 113.853 -162.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 53.4 mp0 -71.13 -32.65 69.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.85 1.26 . . . . 10.0 113.987 178.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.3 mttt -75.68 -28.31 58.61 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 125.252 1.421 . . . . 10.0 111.436 174.53 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.61 -42.42 93.45 Favored Glycine 0 C--N 1.334 0.462 0 N-CA-C 109.951 -1.26 . . . . 10.0 109.951 -173.36 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -62.87 -41.52 99.42 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.85 0.685 . . . . 10.0 112.85 173.099 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -62.21 -54.86 34.84 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.812 1.645 . . . . 10.0 111.323 179.406 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 tp -69.23 -33.4 57.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 122.637 0.375 . . . . 10.0 111.577 -179.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -57.67 -49.7 75.61 Favored 'General case' 0 C--N 1.344 0.356 0 O-C-N 121.663 -0.648 . . . . 10.0 110.672 168.335 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.41 -15.52 10.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.054 -1.029 . . . . 10.0 113.72 178.567 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -92.69 -41.8 9.96 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.291 1.037 . . . . 10.0 112.644 -179.527 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -117.94 -11.12 10.29 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.749 1.389 . . . . 10.0 114.749 -171.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 32.4 m -122.64 -45.94 2.15 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.404 1.482 . . . . 10.0 111.239 -169.739 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.94 -16.4 42.07 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.372 0.878 . . . . 10.0 113.372 175.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -20.62 10.42 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 129.996 3.318 . . . . 10.0 113.699 166.464 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.9 m -142.46 -15.29 0.75 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.763 2.025 . . . . 10.0 113.443 178.413 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -133.43 62.11 1.66 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.691 2.397 . . . . 10.0 109.854 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -64.42 114.93 4.64 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.597 -1.314 . . . . 10.0 109.943 -177.293 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LEU . 24.5 t -140.9 -49.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.675 1.19 . . . . 10.0 111.676 -160.791 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.12 -10.36 1.17 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.021 1.328 . . . . 10.0 113.912 -177.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -150.15 15.56 0.82 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.486 2.714 . . . . 10.0 110.437 -179.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.57 165.35 2.75 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 127.501 2.477 . . . . 10.0 115.232 -174.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 174.2 150.6 7.76 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.262 0.934 . . . . 10.0 113.803 169.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.84 59.86 1.66 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 115.209 1.559 . . . . 10.0 115.209 -171.613 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 m170 64.26 -64.79 0.14 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.79 2.836 . . . . 10.0 114.438 171.9 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt 61.17 -48.57 0.12 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 129.986 3.314 . . . . 10.0 116.052 178.07 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.77 -7.42 0.23 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.209 1.404 . . . . 10.0 112.613 -170.025 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -152.38 169.46 31.58 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.213 1.387 . . . . 10.0 110.648 171.112 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -72.29 9.62 1.13 Allowed 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.983 3.122 . . . . 10.0 115.238 -169.468 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 47.14 162.1 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 129.566 3.146 . . . . 10.0 114.39 -149.408 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.459 ' HB2' HG21 ' A' ' 20' ' ' VAL . 3.6 mm? -80.43 76.08 7.26 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.117 -0.99 . . . . 10.0 108.395 170.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -65.6 -174.01 0.18 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.929 1.292 . . . . 10.0 110.814 166.273 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.22 119.79 2.07 Favored Glycine 0 CA--C 1.537 1.426 0 O-C-N 121.24 -0.913 . . . . 10.0 112.205 166.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.45 -165.34 1.49 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 129.636 3.175 . . . . 10.0 109.137 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.309 76.6 m-85 63.4 -17.38 0.06 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.313 3.045 . . . . 10.0 118.774 173.075 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -138.69 -25.7 0.31 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 127.092 2.282 . . . . 10.0 113.432 163.539 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.4 170.28 12.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.946 1.299 . . . . 10.0 113.159 177.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.18 161.79 17.86 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.962 -1.086 . . . . 10.0 113.395 177.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.5 m -77.79 144.09 37.41 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.699 1.6 . . . . 10.0 110.539 179.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.18 0.39 65.69 Favored Glycine 0 N--CA 1.472 1.098 0 N-CA-C 115.652 1.021 . . . . 10.0 115.652 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -71.19 49.28 0.14 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 127.208 2.203 . . . . 10.0 113.81 -179.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.26 137.24 71.91 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 128.169 2.588 . . . . 10.0 113.394 -178.263 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.63 46.55 1.89 Allowed 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 123.505 2.803 . . . . 10.0 112.758 173.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.55 80.39 1.18 Allowed Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.628 1.585 . . . . 10.0 114.732 173.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -153.07 125.69 8.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.539 1.135 . . . . 10.0 111.425 173.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -79.93 87.78 5.34 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.851 1.261 . . . . 10.0 111.897 179.1 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -83.83 176.86 8.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.48 1.512 . . . . 10.0 112.513 166.25 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 49' ' ' THR . 0.3 OUTLIER -64.62 131.06 45.91 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.684 1.994 . . . . 10.0 109.898 158.766 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -75.13 -159.66 0.1 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.128 0.971 . . . . 10.0 111.67 172.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 58.38 -69.49 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.658 1.983 . . . . 10.0 113.524 -169.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.711 HD22 ' HE3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -51.23 -51.36 54.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.383 1.873 . . . . 10.0 112.747 174.43 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.711 ' HE3' HD22 ' A' ' 52' ' ' ASN . 1.8 mmpt? -72.1 -42.59 65.92 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.592 1.157 . . . . 10.0 113.107 170.584 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.6 -41.19 69.65 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.812 0.845 . . . . 10.0 112.75 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.85 -11.62 60.43 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.379 1.252 . . . . 10.0 114.379 176.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.97 9.02 55.77 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 118.182 2.033 . . . . 10.0 118.182 151.397 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.8 pp -40.64 10.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.236 2 C-N-CA 135.274 5.43 . . . . 10.0 121.893 -154.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 98.3 m 57.03 109.67 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 128.361 2.664 . . . . 10.0 114.646 -173.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.475 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 31.2 m95 -71.28 134.53 46.87 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.575 -1.193 . . . . 10.0 112.091 166.214 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmm -164.89 173.59 11.51 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 131.135 3.774 . . . . 10.0 105.595 173.12 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -57.6 -36.0 71.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 120.442 1.474 . . . . 10.0 114.036 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.97 -54.7 34.35 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.994 1.27 . . . . 10.0 111.165 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 80.8 p -65.77 -38.94 90.42 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.761 0.825 . . . . 10.0 111.928 -179.347 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.13 -27.61 59.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.497 1.044 . . . . 10.0 113.471 175.14 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 19.1 mtm -63.5 -53.45 51.82 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.154 1.343 . . . . 10.0 109.274 170.426 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -59.44 -45.82 90.49 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.916 0.76 . . . . 10.0 109.582 179.138 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -65.36 -48.35 73.27 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.59 -0.719 . . . . 10.0 112.762 -179.163 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.38 -29.45 67.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 120.849 1.659 . . . . 10.0 112.103 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -80.07 -22.82 41.84 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.727 1.38 . . . . 10.0 114.727 174.848 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.99 84.59 1.43 Allowed Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.218 1.407 . . . . 10.0 114.431 169.038 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.27 -49.03 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.364 2.043 . . . . 10.0 113.364 -165.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -71.66 -32.6 68.08 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.618 1.567 . . . . 10.0 111.519 -172.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -71.36 -41.84 69.22 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.603 1.161 . . . . 10.0 111.864 168.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -64.88 -48.92 72.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.18 0.9 . . . . 10.0 113.231 178.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 10.2 pt -128.75 102.39 19.79 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.688 0.795 . . . . 10.0 110.763 173.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.19 136.32 40.16 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.513 2.142 . . . . 10.0 110.752 -177.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.3 -32.39 5.09 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.581 1.562 . . . . 10.0 113.255 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m -50.44 -24.79 3.32 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 118.784 2.883 . . . . 10.0 118.784 -165.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.404 ' HE3' ' N ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 58.29 -82.69 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 116.914 -1.517 . . . . 10.0 111.602 -162.174 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.2 ttt 31.25 95.47 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.398 2.679 . . . . 10.0 113.893 -169.026 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.7 mt -71.69 45.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 C-N-CA 126.772 2.029 . . . . 10.0 112.759 -175.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -163.45 86.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.245 2.218 . . . . 10.0 108.847 178.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.23 -13.73 62.3 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.138 1.532 . . . . 10.0 115.138 -170.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.3 165.12 31.52 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.655 1.121 . . . . 10.0 111.84 176.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.3 tt -95.08 170.36 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.061 1.345 . . . . 10.0 111.968 -178.199 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -45.68 -45.32 14.07 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.616 2.366 . . . . 10.0 114.604 -167.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -164.55 177.87 7.79 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.945 2.498 . . . . 10.0 108.661 168.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -64.36 -27.92 69.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.332 1.605 . . . . 10.0 115.332 -171.26 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.33 -49.95 74.48 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.935 1.698 . . . . 10.0 112.025 -179.824 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -76.66 -6.61 52.78 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.195 1.798 . . . . 10.0 114.569 172.236 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER -78.76 -36.1 43.56 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.634 -1.916 . . . . 10.0 112.502 156.591 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -69.16 -42.69 75.58 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 120.69 -1.256 . . . . 10.0 111.002 174.661 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.503 ' CB ' ' H ' ' A' ' 2' ' ' ASP 0.256 1.0 OUTLIER -60.68 -38.19 84.13 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.909 0.484 . . . . 10.0 112.217 -179.131 . . . . . . . . 4 4 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 mp -57.09 -47.84 80.05 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.581 1.952 . . . . 10.0 113.325 166.823 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.89 -49.69 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.306 0.957 . . . . 10.0 109.458 173.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.4 -46.48 86.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.129 0.972 . . . . 10.0 112.694 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.74 -61.71 2.39 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.094 1.357 . . . . 10.0 111.696 171.452 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.1 -28.24 69.31 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.355 -0.841 . . . . 10.0 112.897 -171.866 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.15 -16.31 63.86 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 172.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -107.38 -24.21 11.92 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.077 1.14 . . . . 10.0 114.077 167.773 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.37 60.46 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.068 1.136 . . . . 10.0 114.068 -177.718 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.1 p -86.92 -4.74 59.21 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.085 1.354 . . . . 10.0 113.668 175.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -153.45 -7.42 0.17 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 116.264 1.95 . . . . 10.0 116.264 -165.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.972 -1.966 . . . . 10.0 114.088 166.549 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.475 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 CA-C-O 118.861 -0.966 . . . . 10.0 111.333 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -134.29 155.61 49.9 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -150.031 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 89.5 t -55.93 -52.87 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 125.25 1.42 . . . . 10.0 110.553 177.042 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.404 ' HA ' ' CE ' ' A' ' 7' ' ' LYS . 4.2 mp0 -53.38 -53.85 45.13 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.036 1.734 . . . . 10.0 113.691 179.172 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -55.57 -36.43 66.83 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.201 0.6 . . . . 10.0 110.828 173.321 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.53 -53.11 8.91 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.414 -1.074 . . . . 10.0 110.414 -172.088 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.404 ' CE ' ' HA ' ' A' ' 4' ' ' GLU . 31.9 pttt -57.54 -46.21 84.14 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.533 1.166 . . . . 10.0 112.466 -179.766 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 mtmt -67.98 -46.23 71.93 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.601 0.76 . . . . 10.0 112.586 -178.682 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.1 mm -65.7 -35.55 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 118.733 0.697 . . . . 10.0 111.252 175.134 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -61.22 -53.6 54.81 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.99 0.814 . . . . 10.0 111.293 172.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.5 t -62.92 -11.63 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.341 -0.849 . . . . 10.0 112.81 -178.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -93.38 -59.27 2.06 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.76 1.624 . . . . 10.0 110.908 174.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -95.75 -12.35 25.53 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.738 1.385 . . . . 10.0 114.738 -168.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.7 m -123.73 -43.68 2.12 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.932 1.293 . . . . 10.0 111.732 -167.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.52 -7.73 5.11 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 167.093 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -16.44 12.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.766 2.027 . . . . 10.0 113.463 163.305 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.1 m -143.34 -27.48 0.56 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.204 1.802 . . . . 10.0 114.053 179.007 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -107.49 -161.68 0.79 Allowed 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 128.916 2.887 . . . . 10.0 111.309 -178.688 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -151.3 -61.79 0.18 Allowed 'General case' 0 N--CA 1.483 1.2 0 O-C-N 119.639 -1.913 . . . . 10.0 113.765 152.714 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.444 ' HB ' ' H ' ' A' ' 32' ' ' LEU 0.277 5.1 p 51.51 -48.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 130.219 3.408 . . . . 10.0 117.786 -175.477 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.15 128.26 34.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.122 1.328 . . . . 10.0 108.02 168.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.5 pttt 45.71 30.64 0.85 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.561 1.544 . . . . 10.0 113.842 -169.033 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.87 -66.88 1.73 Allowed Glycine 0 CA--C 1.528 0.885 0 C-N-CA 126.871 2.177 . . . . 10.0 112.515 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.8 -112.43 4.98 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.673 1.606 . . . . 10.0 113.703 -179.451 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -160.85 -173.78 4.09 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.488 1.515 . . . . 10.0 111.429 -160.885 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -151.77 73.96 1.09 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.078 1.751 . . . . 10.0 110.048 -171.205 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -73.28 -35.14 66.1 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 m -152.16 -29.91 0.16 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.961 -168.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -118.28 164.53 12.84 Favored Glycine 0 CA--C 1.538 1.517 0 N-CA-C 109.373 -1.491 . . . . 10.0 109.373 157.327 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -70.42 167.25 25.85 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.879 2.386 . . . . 10.0 111.413 -178.691 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -64.89 136.9 57.37 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.027 -1.471 . . . . 10.0 107.027 158.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.444 ' H ' ' HB ' ' A' ' 20' ' ' VAL . 2.8 mm? -79.04 66.93 4.61 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.199 -0.938 . . . . 10.0 109.274 -178.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.543 ' HD1' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -52.36 91.29 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 129.276 3.03 . . . . 10.0 111.592 -168.928 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 65.45 -70.26 0.1 OUTLIER Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.286 1.422 . . . . 10.0 111.907 -164.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.519 HD12 ' NH1' ' A' ' 38' ' ' ARG . 0.7 OUTLIER 65.75 -176.33 0.18 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 127.125 2.17 . . . . 10.0 110.411 -168.574 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 55.83 83.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.476 1.51 . . . . 10.0 113.758 179.277 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.3 -7.05 23.01 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.023 2.725 . . . . 10.0 113.638 -177.436 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.543 ' NH1' ' HD1' ' A' ' 33' ' ' HIS . 15.8 ttp180 -86.94 -139.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.099 2.16 . . . . 10.0 114.154 -171.719 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -153.39 162.96 40.75 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.995 2.518 . . . . 10.0 111.073 -177.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 55.0 p -67.21 -59.89 3.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.739 1.216 . . . . 10.0 111.38 178.135 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.04 75.11 0.48 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 125.879 1.704 . . . . 10.0 113.835 -178.427 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -0.34 3.88 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.573 1.694 . . . . 10.0 115.573 175.002 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -52.52 134.45 44.12 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.19 1.396 . . . . 10.0 113.356 -176.689 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -82.45 -107.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.749 2.966 . . . . 10.0 111.053 179.549 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.05 48.38 3.02 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.341 -1.474 . . . . 10.0 112.993 178.508 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -151.7 163.56 38.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.375 1.559 . . . . 10.0 111.997 -177.113 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -154.84 111.37 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.664 1.585 . . . . 10.0 107.03 166.773 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -82.17 -43.22 17.99 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.457 1.503 . . . . 10.0 110.658 -176.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.2 p -156.99 -153.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 129.473 3.109 . . . . 10.0 107.773 177.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -159.86 -171.01 3.08 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.901 1.68 . . . . 10.0 108.226 157.618 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 64.55 -32.14 0.13 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.188 2.195 . . . . 10.0 113.759 -157.772 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -75.37 -42.69 53.4 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 121.975 2.17 . . . . 10.0 113.694 166.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -50.89 -51.22 53.94 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.114 -0.991 . . . . 10.0 111.383 172.294 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -66.13 -16.25 63.8 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.555 1.687 . . . . 10.0 115.555 172.03 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.46 -17.21 59.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.28 1.4 . . . . 10.0 114.224 -179.848 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.82 -44.38 2.05 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.336 -1.813 . . . . 10.0 116.6 170.781 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.5 pp -31.96 3.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.736 2 C-N-CA 133.915 4.886 . . . . 10.0 122.766 -135.232 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 38.3 m 56.21 104.13 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 128.024 2.53 . . . . 10.0 114.889 -177.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -58.31 140.87 52.61 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 113.559 -1.655 . . . . 10.0 110.94 159.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -175.42 -43.29 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.297 1.439 . . . . 10.0 113.763 -165.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.253 13.6 pt-20 163.29 -62.36 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 130.0 3.32 . . . . 10.0 111.715 165.558 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -46.22 -45.21 16.82 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.39 1.476 . . . . 10.0 112.538 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.8 p -68.63 -31.43 70.58 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 125.02 1.328 . . . . 10.0 112.535 178.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -75.43 -33.25 60.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.114 1.324 . . . . 10.0 112.591 168.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.7 mtm -57.31 -53.45 58.02 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.48 1.112 . . . . 10.0 109.235 175.26 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -67.74 -41.4 83.46 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 123.917 0.761 . . . . 10.0 110.622 178.608 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.66 -53.7 25.66 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.787 0.662 . . . . 10.0 112.787 -175.867 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -60.27 -42.79 96.14 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.957 1.253 . . . . 10.0 110.934 179.041 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -72.06 -23.84 61.43 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 114.599 1.333 . . . . 10.0 114.599 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 61.65 1.59 Allowed Pre-proline 0 CA--C 1.564 1.491 0 C-N-CA 125.007 1.323 . . . . 10.0 111.088 -167.294 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.63 -62.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.359 2.706 . . . . 10.0 113.835 -162.106 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -61.58 -26.49 68.0 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.177 1.391 . . . . 10.0 113.613 -178.65 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -71.81 -51.53 22.07 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.015 0.926 . . . . 10.0 110.22 170.854 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -60.76 -47.75 84.9 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.447 0.536 . . . . 10.0 112.447 -177.58 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.85 108.09 9.05 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.319 1.047 . . . . 10.0 109.7 174.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.55 153.46 60.28 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 122.03 1.82 . . . . 10.0 110.616 172.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.74 46.43 4.56 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-O 118.956 -0.913 . . . . 10.0 111.922 -170.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.8 m -138.44 -39.03 0.53 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 116.051 1.871 . . . . 10.0 116.051 -165.911 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt 60.27 -65.74 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 -171.279 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.7 ttt 20.46 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 130.059 3.344 . . . . 10.0 113.063 -171.193 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.524 ' H ' HD12 ' A' ' 81' ' ' ILE . 4.0 mp -69.5 74.25 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 126.423 1.889 . . . . 10.0 110.054 -175.432 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -163.51 -40.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.8 1.64 . . . . 10.0 112.605 178.648 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 34.57 82.6 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.025 2.53 . . . . 10.0 115.253 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 102.63 -161.37 16.88 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.942 1.258 . . . . 10.0 111.445 -169.217 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.6 tt -143.33 30.37 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.637 1.175 . . . . 10.0 110.435 170.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttt 69.35 0.59 2.94 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 127.459 2.304 . . . . 10.0 113.993 -175.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -162.61 173.49 13.86 Favored 'General case' 0 CA--C 1.542 0.649 1 C-N-CA 132.551 4.341 . . . . 10.0 106.979 -176.771 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -77.47 -52.06 9.72 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.895 1.072 . . . . 10.0 113.895 155.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 m -43.65 -50.62 7.39 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.377 1.871 . . . . 10.0 113.054 -155.259 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -65.52 -24.47 67.13 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.652 0.781 . . . . 10.0 112.269 -173.347 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.474 HH21 HD12 ' A' ' 95' ' ' ILE 0.373 0.0 OUTLIER -76.18 -13.0 60.19 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.328 0.967 . . . . 10.0 113.441 172.498 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -67.31 -52.64 37.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.857 0.863 . . . . 10.0 109.979 161.179 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -57.61 -44.28 85.34 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.52 1.528 . . . . 10.0 112.828 177.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.88 90.13 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.991 0.737 . . . . 10.0 112.991 174.303 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.474 HD12 HH21 ' A' ' 91' ' ' ARG . 14.3 mt -62.18 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 119.035 -0.507 . . . . 10.0 110.538 173.583 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.31 75.41 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.43 0.692 . . . . 10.0 111.916 175.307 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -59.2 -57.51 12.72 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.813 1.645 . . . . 10.0 112.946 173.062 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -66.72 -29.12 69.03 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.657 1.117 . . . . 10.0 113.22 -175.019 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -59.27 -26.95 65.37 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.841 0.856 . . . . 10.0 112.919 168.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -85.56 -53.23 5.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 117.821 -1.085 . . . . 10.0 112.009 165.644 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.37 -15.74 39.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.967 1.84 . . . . 10.0 115.967 -171.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.3 t -68.46 -2.78 9.42 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.133 1.161 . . . . 10.0 114.133 165.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -151.2 -23.6 0.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.225 1.81 . . . . 10.0 114.071 -176.218 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.7 2.0 . . . . 10.0 110.921 179.639 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.434 ' CGA' HH22 ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_