data_1pou_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 1pou _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 CA--C 1.53 0.195 0 CA-C-O 119.531 -0.271 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -53.97 -36.47 62.9 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.388 0.675 . . . . 0.0 112.558 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -79.87 -49.12 12.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.553 0.615 . . . . 0.0 109.443 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -51.78 -48.85 63.62 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.843 -0.599 . . . . 0.0 111.786 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -55.95 -62.71 1.52 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 118.801 0.728 . . . . 0.0 111.43 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -59.06 -43.62 91.73 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.612 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -56.0 -52.36 64.5 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 110.196 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -52.3 66.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.142 0.977 . . . . 0.0 110.327 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.66 -48.86 63.25 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.81 0.844 . . . . 0.0 109.884 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.6 m -62.29 -45.82 91.54 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.057 0.543 . . . . 0.0 110.64 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -54.91 -45.95 74.81 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.105 0.562 . . . . 0.0 109.568 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.9 -46.14 85.39 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.03 -0.419 . . . . 0.0 111.258 174.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -59.16 -46.79 87.46 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.248 0.931 . . . . 0.0 110.567 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -58.89 -46.45 87.82 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 122.184 -0.322 . . . . 0.0 110.518 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -55.17 -47.12 75.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.544 0.738 . . . . 0.0 110.948 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 81.9 mt -59.54 -46.96 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 123.109 0.563 . . . . 0.0 109.773 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -57.77 -42.02 83.21 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.468 0.576 . . . . 0.0 111.224 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.47 -15.66 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.24 33.04 72.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 -173.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 122.634 1.207 . . . . 0.0 109.091 -174.921 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t0 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 120.504 0.192 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.1 t -50.81 -50.44 23.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.267 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.83 -44.74 55.62 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.452 0.549 . . . . 0.0 112.389 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.41 -52.1 59.86 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 123.819 0.847 . . . . 0.0 110.396 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.33 -57.42 12.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.437 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 10.5 ttm -50.32 -42.49 52.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.546 1.138 . . . . 0.0 111.293 169.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.55 -54.28 6.61 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 124.721 1.153 . . . . 0.0 111.875 170.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -67.19 -49.08 65.92 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.61 0.364 . . . . 0.0 111.459 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.6 mt -71.66 -53.44 13.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.479 0.712 . . . . 0.0 112.49 -169.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -116.45 -58.18 2.11 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.836 1.654 . . . . 0.0 111.142 -169.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.35 152.38 7.61 Favored Glycine 0 CA--C 1.532 1.122 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 -171.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.63 60.91 1.73 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.283 1.433 . . . . 0.0 113.216 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -110.36 174.32 5.92 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.768 1.227 . . . . 0.0 108.029 172.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 66.7 39.88 3.46 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.379 1.072 . . . . 0.0 112.302 176.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -74.85 57.65 0.79 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.565 1.546 . . . . 0.0 109.855 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 72.53 -53.03 0.7 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.361 1.465 . . . . 0.0 111.25 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -41.66 -70.8 0.1 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 127.761 2.424 . . . . 0.0 111.715 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.96 -32.83 74.24 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.259 0.624 . . . . 0.0 111.461 -171.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 18.2 mm -60.52 -53.56 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 171.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -53.94 -48.37 70.31 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.999 -0.438 . . . . 0.0 110.535 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -56.71 -42.83 79.87 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.498 175.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -57.85 -55.52 33.8 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.876 0.47 . . . . 0.0 110.311 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -57.13 -38.03 72.87 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.551 176.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.28 -1.36 26.21 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.7 mp 51.26 30.58 5.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.231 1.813 . . . . 0.0 112.988 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -83.9 35.22 0.52 Allowed 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.897 -1.127 . . . . 0.0 111.004 -174.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.7 mt -139.86 19.66 2.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.666 1.586 . . . . 0.0 110.513 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.0 m 28.64 60.84 0.13 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.336 2.655 . . . . 0.0 116.029 169.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.2 t80 68.89 -58.59 0.49 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.51 1.924 . . . . 0.0 114.417 171.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -41.3 -56.0 2.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 113.262 -170.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -76.69 -49.69 15.5 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.565 0.698 . . . . 0.0 109.365 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 89.0 mtp -45.12 -44.8 10.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.602 1.561 . . . . 0.0 112.847 -173.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.9 t -59.77 -35.67 75.11 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.9 0.48 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.5 mttp -79.38 -35.97 39.92 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.644 0.778 . . . . 0.0 110.066 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -65.32 -45.3 84.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.074 0.95 . . . . 0.0 112.132 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -44.67 -62.25 1.7 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.212 1.005 . . . . 0.0 113.434 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -60.28 -34.53 93.66 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 121.974 1.783 . . . . 0.0 112.33 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.1 -48.28 80.87 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 mt -64.24 -38.76 92.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 118.108 0.413 . . . . 0.0 111.507 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.09 -51.62 69.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.91 0.777 . . . . 0.0 109.881 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -60.93 -39.06 87.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.545 0.338 . . . . 0.0 110.162 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -56.98 -44.8 83.06 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 121.761 -0.587 . . . . 0.0 109.916 173.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -47.32 86.36 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.921 0.888 . . . . 0.0 109.426 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.96 -46.65 78.53 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.974 0.509 . . . . 0.0 110.915 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -67.37 -51.2 54.99 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.568 1.147 . . . . 0.0 112.204 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 128.29 2.636 . . . . 0.0 113.959 -174.348 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -47.74 -40.6 20.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.66 0.784 . . . . 0.0 111.98 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.35 -43.84 93.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.893 -0.505 . . . . 0.0 109.806 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.98 -49.1 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.426 1.09 . . . . 0.0 110.328 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -54.6 44.55 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.145 0.884 . . . . 0.0 110.882 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -55.14 -51.05 67.7 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -54.88 -49.7 70.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.882 0.473 . . . . 0.0 110.974 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.9 -51.35 67.91 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 110.651 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -62.59 -42.7 99.72 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.936 -0.477 . . . . 0.0 110.725 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.8 m -61.02 -44.94 96.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.174 0.589 . . . . 0.0 110.258 176.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -55.71 -48.33 75.34 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.811 1.244 . . . . 0.0 109.042 176.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -55.31 -45.13 76.33 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.183 173.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -59.18 -49.43 77.88 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.226 0.921 . . . . 0.0 110.645 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -55.29 -47.01 76.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.012 -0.43 . . . . 0.0 110.694 176.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.3 ttp85 -57.8 -45.05 86.65 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 110.949 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.9 mt -61.99 -46.75 95.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 C-N-CA 123.385 0.674 . . . . 0.0 109.822 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.28 -41.01 78.93 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.801 0.728 . . . . 0.0 110.848 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.99 -13.43 62.45 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 173.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.54 29.37 72.91 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 123.891 0.758 . . . . 0.0 111.286 -177.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 . . . . . 0 N--CA 1.455 -0.212 0 CA-C-N 117.448 0.624 . . . . 0.0 109.821 -177.966 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.67 -40.4 79.23 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-O 118.622 -0.704 . . . . 0.0 109.339 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.15 -57.44 6.3 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 174.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.4 tp -60.71 -43.27 98.04 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.561 0.744 . . . . 0.0 109.725 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.51 78.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.381 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 31.2 mmm -65.99 -45.98 79.65 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -38.38 -51.05 2.33 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 126.813 2.149 . . . . 0.0 111.919 172.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -57.43 -40.31 78.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.0 mt -99.5 -53.87 3.09 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.671 0.388 . . . . 0.0 111.547 -169.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -112.58 -48.68 2.99 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.709 1.604 . . . . 0.0 110.908 -169.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.02 155.59 6.48 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 108.681 -1.768 . . . . 0.0 108.681 -169.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -76.96 68.27 3.1 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.119 0.96 . . . . 0.0 110.273 -173.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -85.2 -58.45 2.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.346 0.658 . . . . 0.0 109.714 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -93.27 89.84 6.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.999 -0.438 . . . . 0.0 111.868 -168.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 m -100.34 -179.24 4.06 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 169.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -51.25 -36.28 41.17 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.7 p -53.04 -73.59 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.795 0.838 . . . . 0.0 109.82 172.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -43.33 65.74 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.547 1.139 . . . . 0.0 111.807 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.77 -48.04 81.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 O-C-N 121.504 -0.747 . . . . 0.0 111.47 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.7 p -56.01 -45.14 79.17 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.395 -1.441 . . . . 0.0 110.201 174.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -37.07 75.28 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.961 0.504 . . . . 0.0 111.915 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -58.88 -55.45 34.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.139 0.976 . . . . 0.0 110.012 173.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.15 -27.94 69.72 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.12 -4.34 56.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.5 0.72 . . . . 0.0 112.436 171.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp 53.96 31.44 13.47 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.071 2.148 . . . . 0.0 113.996 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -92.25 27.64 2.15 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.538 -0.726 . . . . 0.0 111.494 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 mt -128.85 31.06 5.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.901 1.68 . . . . 0.0 107.887 170.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 m -33.73 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 129.913 3.285 . . . . 0.0 114.704 -168.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 23.0 t80 68.65 -58.24 0.48 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.745 2.418 . . . . 0.0 113.323 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -43.14 -51.71 5.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.902 1.681 . . . . 0.0 113.074 -172.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -81.55 -48.32 11.95 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.9 mtt -43.84 -40.41 4.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 126.195 1.798 . . . . 0.0 112.761 -173.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.7 t -66.94 -23.37 65.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.085 -1.046 . . . . 0.0 113.063 -176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.62 -55.22 3.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.905 0.86 . . . . 0.0 108.701 169.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -48.02 -44.23 30.78 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.109 2.164 . . . . 0.0 112.294 -177.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -63.64 -62.95 4.53 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.436 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.55 -37.01 96.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.205 1.27 . . . . 0.0 111.881 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.0 -49.91 72.83 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.0 mt -61.88 -40.34 95.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.312 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -57.0 -53.7 55.12 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.78 0.718 . . . . 0.0 109.795 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -58.93 -46.02 88.98 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.679 0.392 . . . . 0.0 110.438 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -54.56 -45.09 73.42 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.479 0.312 . . . . 0.0 110.639 176.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.83 -44.44 85.55 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.01 -40.05 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.768 0.427 . . . . 0.0 110.503 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.69 -59.47 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.17 0.588 . . . . 0.0 111.488 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.174 0 C-N-CA 124.266 1.026 . . . . 0.0 112.563 -169.4 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 N--CA 1.455 -0.19 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -53.86 -47.51 70.95 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.587 0.355 . . . . 0.0 110.967 173.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -65.55 -43.35 90.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.501 0.721 . . . . 0.0 110.053 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.14 -47.09 81.99 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.737 0.415 . . . . 0.0 110.404 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -56.63 18.96 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.546 0.738 . . . . 0.0 110.298 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -52.27 -54.18 34.51 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.738 0.815 . . . . 0.0 109.077 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -54.95 -49.92 70.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.634 0.774 . . . . 0.0 111.055 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.51 -52.97 60.28 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.159 0.89 . . . . 0.0 110.814 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -60.32 -38.69 84.49 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.49 -0.757 . . . . 0.0 111.132 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 85.7 m -65.2 -44.63 87.73 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.552 -0.717 . . . . 0.0 109.829 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -53.07 -54.06 41.05 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.807 1.243 . . . . 0.0 108.865 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.43 -52.33 62.12 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 177.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -56.65 -54.29 47.74 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.934 -0.479 . . . . 0.0 111.367 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -57.25 -48.32 79.16 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 122.094 -0.379 . . . . 0.0 110.528 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.7 ttp85 -50.79 -50.42 56.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.766 0.826 . . . . 0.0 110.569 176.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.78 -49.26 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 C-N-CA 122.979 0.512 . . . . 0.0 110.023 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -55.48 -42.41 74.32 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.82 0.737 . . . . 0.0 111.239 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.5 mt -68.54 -17.87 64.24 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.377 0.671 . . . . 0.0 112.075 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.93 25.7 75.16 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 122.096 0.95 . . . . 0.0 108.46 -176.739 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 CA--C 1.529 0.146 0 N-CA-C 110.566 -0.161 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.87 -56.31 13.31 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.56 -48.77 34.74 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 123.811 0.72 . . . . 0.0 111.746 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.62 -54.86 29.22 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.451 0.643 . . . . 0.0 110.933 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.63 -48.97 77.98 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.964 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -40.3 81.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.471 0.708 . . . . 0.0 110.413 174.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -46.88 -55.89 8.0 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 125.004 1.287 . . . . 0.0 111.112 169.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -61.42 -48.22 82.17 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -80.99 -28.93 35.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -145.16 -63.53 0.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 111.049 -172.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.87 140.52 3.34 Favored Glycine 0 CA--C 1.529 0.945 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 -169.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.28 61.06 5.31 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 122.112 -0.64 . . . . 0.0 111.351 -168.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -81.64 -151.86 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 64.4 31.9 12.35 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.422 -0.799 . . . . 0.0 112.085 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -76.77 54.2 0.97 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.078 1.751 . . . . 0.0 110.235 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 66.39 -67.36 0.15 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.983 1.713 . . . . 0.0 109.99 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.2 p -28.45 -73.4 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 128.16 2.584 . . . . 0.0 111.838 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.8 m -53.49 -37.85 63.12 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.373 1.869 . . . . 0.0 112.714 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -75.02 -48.96 30.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 121.631 -0.668 . . . . 0.0 109.829 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.9 m -53.95 -48.77 69.94 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.587 -0.696 . . . . 0.0 110.652 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -58.52 -40.76 83.79 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.522 1.129 . . . . 0.0 110.936 176.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -57.56 -56.62 19.57 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.311 0.505 . . . . 0.0 110.31 175.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -65.55 -25.28 67.36 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.71 -5.13 44.17 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.058 0.845 . . . . 0.0 112.083 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 50.03 42.39 24.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.508 1.923 . . . . 0.0 111.552 -171.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -79.86 -34.68 39.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.78 0.832 . . . . 0.0 112.005 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.38 52.11 1.55 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.899 0.88 . . . . 0.0 111.931 -169.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 m -24.17 85.43 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.515 3.126 . . . . 0.0 116.757 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 t80 68.43 -57.76 0.48 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.759 2.424 . . . . 0.0 114.224 170.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -43.32 -50.98 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.198 1.799 . . . . 0.0 112.358 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -46.54 22.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 62.6 mtt -46.81 -44.91 19.68 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.913 1.285 . . . . 0.0 112.136 -172.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 22.2 t -64.39 -22.18 66.87 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -175.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.3 -51.91 5.32 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.063 0.935 . . . . 0.0 108.607 171.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.3 tp -47.1 -45.49 22.17 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 127.669 2.388 . . . . 0.0 112.041 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -63.66 -64.14 3.22 Favored Pre-proline 0 N--CA 1.453 -0.286 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.371 -176.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -56.28 -39.46 91.13 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 CA-C-N 120.87 1.346 . . . . 0.0 111.202 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tt -53.66 -57.7 9.85 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 123.005 0.522 . . . . 0.0 111.563 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 83.2 mt -70.75 -31.18 67.91 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.151 0.58 . . . . 0.0 110.958 -178.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.84 -46.17 89.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.73 -41.91 91.65 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.131 -0.356 . . . . 0.0 110.116 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -52.53 -46.73 66.85 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.156 0.434 . . . . 0.0 110.325 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.45 -46.78 86.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.11 -52.17 53.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.806 0.275 . . . . 0.0 110.638 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.79 -54.46 46.87 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.782 0.433 . . . . 0.0 111.709 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.272 0 C-N-CA 124.64 1.176 . . . . 0.0 111.652 -173.458 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 119.719 -0.182 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.31 -54.23 47.89 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.764 0.426 . . . . 0.0 109.966 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.97 -44.32 91.49 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.347 0.659 . . . . 0.0 110.95 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -57.93 -48.07 81.01 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.713 0.405 . . . . 0.0 110.712 176.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -55.84 29.79 Favored 'General case' 0 C--N 1.337 0.05 0 C-N-CA 123.134 0.574 . . . . 0.0 109.658 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -54.23 -51.91 63.0 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.67 0.388 . . . . 0.0 110.262 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -54.43 -53.76 49.89 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.452 0.701 . . . . 0.0 110.688 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.91 92.03 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.756 0.422 . . . . 0.0 111.114 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.5 ttpm? -56.36 -45.43 80.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.766 0.826 . . . . 0.0 109.798 174.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.3 m -63.57 -42.03 98.34 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.064 -0.397 . . . . 0.0 110.808 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -55.46 -51.1 68.06 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.35 -51.91 66.54 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.958 0.503 . . . . 0.0 110.85 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -45.97 88.73 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.745 -0.597 . . . . 0.0 110.421 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -65.98 -45.84 80.22 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.797 0.439 . . . . 0.0 109.848 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.4 ttp85 -50.58 -51.81 44.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 109.988 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 88.3 mt -59.42 -48.54 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.5 -42.46 78.38 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.4 0.546 . . . . 0.0 111.372 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.59 -16.23 63.79 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.7 0.8 . . . . 0.0 111.722 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.7 28.44 73.76 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -176.11 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 119.938 -0.077 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.09 -48.38 89.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -176.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.92 -52.74 24.99 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 118.744 0.702 . . . . 0.0 111.659 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.11 -56.36 21.72 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.843 0.857 . . . . 0.0 110.46 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.73 -45.77 91.16 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.018 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mmm -55.51 -45.99 77.02 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 121.814 -0.554 . . . . 0.0 110.053 170.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.44 -57.08 4.55 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.754 1.168 . . . . 0.0 111.794 169.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -59.25 -50.5 73.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.787 0.293 . . . . 0.0 111.344 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.8 mt -78.14 -29.5 48.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -171.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.541 ' HH ' ' HZ1' ' A' ' 69' ' ' LYS . 84.3 m-85 -146.24 -61.4 0.31 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.127 0.971 . . . . 0.0 111.456 -172.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 164.96 138.7 2.47 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 107.616 -2.193 . . . . 0.0 107.616 -169.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -78.73 38.87 0.33 Allowed 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.665 -0.903 . . . . 0.0 113.268 -168.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -81.38 41.75 0.63 Allowed 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.289 -0.882 . . . . 0.0 111.362 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -147.45 33.81 0.87 Allowed 'General case' 0 CA--C 1.524 -0.033 0 C-N-CA 124.094 0.958 . . . . 0.0 109.971 -169.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.6 m -73.07 64.58 0.73 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.814 1.246 . . . . 0.0 110.266 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 68.96 -60.56 0.45 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.413 1.885 . . . . 0.0 111.972 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 m -45.12 -66.3 0.42 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.9 1.28 . . . . 0.0 111.797 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.49 -41.07 69.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.267 1.027 . . . . 0.0 111.729 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.7 mm -64.73 -43.79 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.483 0.713 . . . . 0.0 109.991 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.436 ' HG ' HH21 ' A' ' 49' ' ' ARG . 85.6 p -65.42 -43.34 90.84 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.751 -0.593 . . . . 0.0 110.731 176.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.436 HH21 ' HG ' ' A' ' 48' ' ' SER . 4.8 mmp_? -58.88 -45.94 89.02 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 118.51 0.596 . . . . 0.0 109.707 177.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -55.73 -57.95 9.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.254 1.022 . . . . 0.0 110.327 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -62.19 -34.99 77.5 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 -3.86 30.06 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 172.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 59.1 28.78 18.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.953 1.701 . . . . 0.0 111.926 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.35 -34.69 58.94 Favored 'General case' 0 C--N 1.333 -0.125 0 O-C-N 121.133 -0.98 . . . . 0.0 109.002 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 68.5 mt -62.98 -5.05 2.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 112.388 170.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.0 m 69.91 -65.16 0.32 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.722 1.609 . . . . 0.0 115.18 166.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -166.18 -53.28 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.826 0.739 . . . . 0.0 111.489 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -46.37 -51.54 14.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.924 0.889 . . . . 0.0 113.202 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -77.73 -52.15 9.4 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.6 mmm -38.04 -51.22 1.38 Allowed 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 126.338 1.855 . . . . 0.0 111.267 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 31.3 t -65.8 -29.28 69.74 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -84.63 -40.39 17.52 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.975 0.893 . . . . 0.0 108.978 175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -67.74 -35.02 77.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.844 1.257 . . . . 0.0 113.584 -176.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -50.33 -67.39 0.47 Allowed Pre-proline 0 CA--C 1.536 0.406 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.885 173.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -57.75 -37.03 98.01 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.907 1.738 . . . . 0.0 111.394 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tt -53.6 -55.38 26.27 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.611 0.764 . . . . 0.0 111.117 173.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.3 mt -66.71 -31.9 72.86 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.781 -0.574 . . . . 0.0 112.02 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.09 -47.71 78.98 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.573 -0.704 . . . . 0.0 109.254 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.541 ' HZ1' ' HH ' ' A' ' 38' ' ' TYR . 8.4 mtmp? -64.2 -39.98 95.12 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 119.245 -0.407 . . . . 0.0 110.608 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 68.8 t90 -52.42 -49.1 65.21 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.459 0.572 . . . . 0.0 110.181 169.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.72 -47.48 85.07 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -175.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.81 -53.27 50.94 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.823 0.449 . . . . 0.0 110.69 175.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.82 -50.09 75.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.674 0.39 . . . . 0.0 111.41 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.238 0 C-N-CA 124.903 1.281 . . . . 0.0 111.449 -175.693 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mp . . . . . 0 CA--C 1.53 0.196 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -52.48 -40.6 62.51 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.935 0.894 . . . . 0.0 111.902 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -70.58 -54.37 12.32 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.5 mt -52.25 -52.96 49.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 112.102 -171.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.18 -59.73 4.28 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.57 0.7 . . . . 0.0 111.588 -174.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -53.24 -60.22 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.411 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -50.6 -50.19 54.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.187 0.995 . . . . 0.0 111.35 -172.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.32 -53.24 60.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.556 0.693 . . . . 0.0 110.476 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -65.49 -22.74 66.76 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.66 -0.65 . . . . 0.0 111.542 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 57.6 m -75.96 -40.38 54.08 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.366 -0.834 . . . . 0.0 109.455 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.62 -48.44 72.21 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 170.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.2 tttp -54.38 -55.65 26.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.699 0.285 . . . . 0.0 111.671 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -57.41 -52.07 66.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.746 -0.596 . . . . 0.0 111.218 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpt85 -60.26 -44.67 95.08 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.161 0.584 . . . . 0.0 110.421 -178.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 58.9 ttp85 -52.72 -49.41 65.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.073 0.949 . . . . 0.0 110.482 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 75.1 mt -59.66 -46.87 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-O 119.128 -0.463 . . . . 0.0 110.059 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -57.02 -42.12 79.82 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.085 0.857 . . . . 0.0 111.299 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.24 -18.42 65.34 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.741 0.416 . . . . 0.0 112.086 174.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.09 24.43 74.6 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 -172.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 122.609 1.195 . . . . 0.0 108.492 -175.667 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t70 . . . . . 0 C--O 1.232 0.181 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.4 t -57.74 -52.43 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.22 -48.51 47.0 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.39 -56.92 15.19 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 117.494 0.647 . . . . 0.0 110.167 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.03 -46.22 90.22 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.894 -176.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -47.02 60.99 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.957 1.303 . . . . 0.0 109.41 170.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -48.8 -59.15 6.95 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.943 1.259 . . . . 0.0 112.307 169.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.25 -47.81 77.79 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 117.06 0.43 . . . . 0.0 111.409 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.1 mt -73.5 -50.35 21.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -126.3 -59.05 1.33 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.938 0.895 . . . . 0.0 112.0 -168.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 158.55 135.1 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -169.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -82.39 73.6 9.41 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.699 -0.883 . . . . 0.0 110.331 -170.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.79 27.67 2.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.311 167.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -148.13 47.17 1.07 Allowed 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.852 -0.53 . . . . 0.0 110.403 -167.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.2 p -60.04 -59.88 4.71 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.921 0.888 . . . . 0.0 109.154 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -159.29 -54.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.062 1.345 . . . . 0.0 109.029 -177.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.0 p -48.69 -69.74 0.11 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.414 1.485 . . . . 0.0 111.023 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.2 m -49.12 -49.14 43.48 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.22 1.408 . . . . 0.0 111.363 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.6 mm -60.21 -47.8 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.993 0.917 . . . . 0.0 110.533 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m -62.59 -48.19 80.54 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.205 -0.309 . . . . 0.0 110.475 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -36.88 82.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.284 0.634 . . . . 0.0 110.925 178.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -63.6 -52.28 61.61 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 118.671 0.669 . . . . 0.0 110.639 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -58.22 -33.25 69.11 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.661 0.784 . . . . 0.0 112.082 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.47 8.89 22.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.066 0.946 . . . . 0.0 112.373 172.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.5 mp 36.83 44.88 0.38 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.64 2.376 . . . . 0.0 113.459 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -85.52 -53.05 5.43 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.713 1.205 . . . . 0.0 108.955 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.87 101.61 0.22 Allowed 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.11 -179.89 1.36 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.053 1.741 . . . . 0.0 114.357 -167.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -40.53 -46.79 2.56 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.825 1.65 . . . . 0.0 113.906 -169.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -41.46 -46.16 3.37 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.249 1.42 . . . . 0.0 112.555 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -79.02 -58.43 3.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.69 0.796 . . . . 0.0 108.886 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 41.4 mtt -44.95 -49.89 10.86 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.785 1.234 . . . . 0.0 112.117 -170.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.4 t -66.19 -36.95 84.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.629 -169.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -74.01 -43.18 58.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.498 0.666 . . . . 0.0 109.677 172.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.3 tp -64.64 -46.5 82.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.864 0.866 . . . . 0.0 112.003 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -52.33 -56.55 21.27 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.961 -173.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.06 -36.51 89.07 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 CA-C-N 121.247 1.481 . . . . 0.0 111.824 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -61.21 -52.08 66.29 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -63.14 -38.9 93.0 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.349 0.66 . . . . 0.0 111.341 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -58.74 -51.94 67.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -64.08 -40.05 95.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.282 -0.261 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 54.4 t90 -53.78 -46.72 71.11 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 172.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.64 -46.23 80.03 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.89 -51.81 59.82 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.016 0.526 . . . . 0.0 110.906 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -58.73 -50.95 72.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.359 0.664 . . . . 0.0 111.099 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 124.022 0.929 . . . . 0.0 111.382 -178.408 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -54.49 -36.98 64.74 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.053 -1.029 . . . . 0.0 109.49 168.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -61.96 -50.26 72.83 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.283 0.633 . . . . 0.0 109.741 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -55.69 -43.39 76.38 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 124.358 1.063 . . . . 0.0 109.688 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -55.48 22.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.592 0.757 . . . . 0.0 109.397 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -54.08 -56.23 20.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -50.63 -54.11 25.44 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.184 0.594 . . . . 0.0 110.992 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.74 -50.38 73.7 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.785 -0.572 . . . . 0.0 110.475 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -28.02 68.76 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.73 -0.606 . . . . 0.0 111.384 176.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 90.1 m -70.92 -45.47 64.19 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -55.04 -44.31 74.56 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.728 0.411 . . . . 0.0 110.08 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -55.97 -54.1 48.88 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.99 -0.444 . . . . 0.0 110.741 174.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -55.1 -46.33 75.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.995 -0.441 . . . . 0.0 111.002 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -53.44 -50.68 64.75 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.186 0.448 . . . . 0.0 110.298 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -54.34 -48.01 71.88 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.559 0.618 . . . . 0.0 111.658 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.39 -54.86 20.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.399 0.545 . . . . 0.0 109.724 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -55.52 -43.85 76.09 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.082 0.401 . . . . 0.0 111.148 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.05 -14.25 60.21 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.355 0.662 . . . . 0.0 112.279 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.16 34.88 87.53 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -173.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 . . . . . 0 C--O 1.234 0.269 0 CA-C-O 122.146 0.974 . . . . 0.0 110.182 -176.631 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.327 0.584 . . . . 0.0 109.654 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.7 t -50.39 -49.61 23.44 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.992 171.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.9 -46.33 32.11 Favored Glycine 0 CA--C 1.527 0.809 0 C-N-CA 123.816 0.722 . . . . 0.0 113.75 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.3 -50.89 68.3 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.28 1.04 . . . . 0.0 110.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.93 -52.42 65.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.158 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -37.96 58.29 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.886 1.274 . . . . 0.0 109.772 169.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -49.72 -59.83 6.98 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 125.612 1.577 . . . . 0.0 111.16 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -62.84 -39.91 95.83 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.517 0.198 . . . . 0.0 111.306 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.0 tp -84.87 -23.91 28.77 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -168.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -148.96 -65.19 0.23 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.398 1.879 . . . . 0.0 110.601 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 177.27 139.95 3.49 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 -169.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.7 62.46 5.54 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 117.521 0.661 . . . . 0.0 112.355 -167.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -92.24 -155.04 0.4 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.44 40.44 20.76 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 120.843 -1.161 . . . . 0.0 113.894 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -75.51 50.48 0.54 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.092 1.357 . . . . 0.0 108.901 169.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 67.29 -42.28 0.43 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.182 1.793 . . . . 0.0 112.023 -167.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -42.26 -70.49 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.955 2.102 . . . . 0.0 113.216 -173.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 p -65.41 -40.46 93.41 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.54 -0.725 . . . . 0.0 110.409 -174.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.1 mm -54.37 -41.31 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.167 0.987 . . . . 0.0 110.712 173.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.5 m -68.62 -48.37 64.25 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.482 -0.761 . . . . 0.0 109.782 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -58.81 -33.65 70.62 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.756 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.18 -52.29 36.12 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 126.216 1.806 . . . . 0.0 110.531 174.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -60.6 -23.8 64.98 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.62 0.768 . . . . 0.0 112.455 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.03 -6.32 55.67 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 0.0 112.463 169.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.77 41.15 32.13 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 127.075 2.15 . . . . 0.0 112.095 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.29 -7.18 24.85 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.8 mt -83.73 50.53 1.82 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.753 1.16 . . . . 0.0 111.176 -175.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 42.62 31.23 0.28 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.897 2.879 . . . . 0.0 116.038 170.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 t80 67.84 -50.81 0.52 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.21 1.804 . . . . 0.0 113.019 -174.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -38.45 -53.46 1.54 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.593 1.957 . . . . 0.0 112.786 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.88 -49.02 19.09 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 mtp -47.78 -47.2 30.81 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.626 1.571 . . . . 0.0 110.699 -174.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.5 t -59.17 -34.37 72.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.688 0.795 . . . . 0.0 113.106 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -85.37 -36.03 21.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.007 0.908 . . . . 0.0 110.124 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -62.93 -38.74 92.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.223 1.009 . . . . 0.0 110.661 -178.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -53.04 -64.08 1.9 Allowed Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.797 176.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -58.46 -39.02 87.37 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.027 1.818 . . . . 0.0 111.679 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -53.18 -52.58 58.35 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.877 0.762 . . . . 0.0 111.182 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.8 mt -69.35 -36.52 76.95 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.706 -0.621 . . . . 0.0 111.99 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -57.56 -49.76 75.33 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.835 0.743 . . . . 0.0 109.045 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -63.74 -42.24 97.91 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.529 0.332 . . . . 0.0 110.137 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.5 t90 -52.84 -47.04 68.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.217 0.462 . . . . 0.0 110.585 170.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -51.12 70.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -47.53 74.33 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.044 0.538 . . . . 0.0 110.335 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -59.13 -52.88 63.8 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.437 0.695 . . . . 0.0 110.575 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.204 0 C-N-CA 123.219 0.607 . . . . 0.0 110.181 177.801 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 119.551 -0.261 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -48.99 -47.71 44.04 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.387 1.075 . . . . 0.0 110.855 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -57.53 -45.86 84.53 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.349 0.26 . . . . 0.0 110.988 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.53 -53.12 61.31 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 124.573 1.149 . . . . 0.0 110.832 -175.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -57.66 11.83 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.216 0.462 . . . . 0.0 110.581 -177.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -54.93 -49.48 71.22 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -55.44 -50.61 69.37 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.341 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.72 -51.9 64.16 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.348 0.976 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp -59.77 -38.38 81.69 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.0 m -64.9 -44.7 88.72 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 121.706 -0.622 . . . . 0.0 109.78 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.52 -48.76 68.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.736 1.214 . . . . 0.0 109.544 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.95 -45.49 92.46 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 174.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.11 -45.35 83.5 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.013 -1.054 . . . . 0.0 111.247 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -60.95 -44.58 97.07 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 121.547 -0.721 . . . . 0.0 110.576 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -50.09 -48.97 52.95 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.657 0.783 . . . . 0.0 110.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -61.25 -51.26 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 122.951 0.5 . . . . 0.0 110.047 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -56.44 -41.39 76.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.892 0.769 . . . . 0.0 112.228 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.88 -12.06 61.19 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.698 0.799 . . . . 0.0 111.752 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.79 33.39 87.12 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -173.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 CA--C 1.519 -0.245 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.829 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t0 . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 120.425 0.155 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -58.43 -52.22 61.92 Favored 'Isoleucine or valine' 0 C--N 1.342 0.244 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 172.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.96 -50.54 15.19 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 123.454 0.549 . . . . 0.0 111.885 174.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.7 tp -59.51 -57.57 12.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 117.723 0.762 . . . . 0.0 111.107 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.35 97.29 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.103 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.413 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 66.9 mmm -55.34 -44.1 75.6 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.762 -0.586 . . . . 0.0 110.052 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.76 -57.83 5.1 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 124.728 1.156 . . . . 0.0 111.299 169.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -57.44 -50.17 73.88 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 35.2 mt -83.37 -25.61 31.23 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -169.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -145.88 -61.37 0.33 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.55 1.14 . . . . 0.0 111.046 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 166.11 137.48 2.22 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 107.641 -2.184 . . . . 0.0 107.641 -169.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.07 36.44 0.23 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -167.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -83.33 38.51 0.61 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.096 -1.003 . . . . 0.0 111.414 -172.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -152.75 42.79 0.63 Allowed 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 124.377 1.071 . . . . 0.0 109.671 -169.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 p -56.2 -62.05 1.97 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 170.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -154.43 -47.64 0.09 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.474 1.11 . . . . 0.0 111.106 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -47.66 -67.07 0.31 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.969 1.308 . . . . 0.0 114.295 -169.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 12.5 p -56.79 -49.43 75.35 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.047 0.939 . . . . 0.0 110.341 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.4 mm -53.89 -47.74 63.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.753 1.221 . . . . 0.0 110.909 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.9 m -60.02 -48.17 82.81 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.226 -0.921 . . . . 0.0 110.121 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -59.11 -31.15 68.66 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.165 0.586 . . . . 0.0 111.298 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.62 -57.62 7.7 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 124.092 0.957 . . . . 0.0 110.051 174.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.33 -26.45 68.77 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.87 -6.92 59.24 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.665 0.666 . . . . 0.0 112.428 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.9 mp 48.03 49.39 17.26 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.706 2.003 . . . . 0.0 113.082 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.0 -32.1 27.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.657 0.783 . . . . 0.0 110.678 174.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 42.0 mt -81.18 46.17 0.9 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.825 0.85 . . . . 0.0 112.511 -168.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 m -21.93 85.35 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 129.28 3.032 . . . . 0.0 116.568 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.3 t80 69.25 -57.37 0.53 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.352 2.261 . . . . 0.0 114.025 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -46.09 -51.54 13.67 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.465 1.506 . . . . 0.0 112.519 -172.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -46.47 30.27 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtt -46.95 -44.37 19.93 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.944 1.298 . . . . 0.0 111.715 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.3 t -60.72 -29.82 69.59 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -84.49 -47.49 10.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.273 1.035 . . . . 0.0 109.245 172.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.1 -40.58 70.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.164 1.786 . . . . 0.0 111.764 -175.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -60.58 -66.9 1.25 Allowed Pre-proline 0 CA--C 1.536 0.414 0 CA-C-O 117.995 -1.003 . . . . 0.0 111.039 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.61 -40.14 80.35 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.193 1.929 . . . . 0.0 111.726 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.04 -57.02 11.79 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.255 0.622 . . . . 0.0 111.299 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.1 mt -69.53 -35.0 75.05 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -58.71 -49.81 76.22 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.996 0.816 . . . . 0.0 110.131 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -44.94 90.65 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.413 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 76.7 t90 -50.96 -48.82 60.92 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.165 -0.335 . . . . 0.0 110.843 172.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.19 -51.86 67.23 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.78 -46.01 74.36 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.768 0.427 . . . . 0.0 110.316 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.66 -53.08 61.82 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.113 0.565 . . . . 0.0 110.489 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.261 0 C-N-CA 123.227 0.611 . . . . 0.0 110.204 178.316 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp . . . . . 0 CA--C 1.533 0.314 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -45.46 -47.59 13.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.004 0.922 . . . . 0.0 111.255 174.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.41 -47.31 84.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -52.22 60.66 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.222 1.009 . . . . 0.0 111.572 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -53.35 57.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.511 1.051 . . . . 0.0 110.974 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -59.88 -40.88 90.21 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.881 -0.512 . . . . 0.0 110.93 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -54.4 -51.17 65.7 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 121.717 -0.614 . . . . 0.0 109.98 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.64 -46.89 77.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.728 0.694 . . . . 0.0 111.821 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.2 -40.91 82.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.311 0.576 . . . . 0.0 111.036 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.7 m -63.28 -43.85 96.73 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.49 -0.756 . . . . 0.0 109.668 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -60.94 -45.22 95.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.551 1.141 . . . . 0.0 110.174 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -49.14 -52.16 27.94 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.143 0.429 . . . . 0.0 110.262 170.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -59.83 -50.87 72.11 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.797 -0.564 . . . . 0.0 111.257 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -55.85 -48.83 74.82 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.559 0.618 . . . . 0.0 110.59 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.3 ttp85 -52.84 -47.61 67.62 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 110.61 176.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 67.2 mt -60.11 -46.58 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.116 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -58.2 -40.88 82.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.191 0.905 . . . . 0.0 111.276 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.23 -13.1 59.79 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.933 -0.479 . . . . 0.0 112.112 173.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.87 27.74 73.59 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -174.545 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 CA--C 1.535 0.399 0 CA-C-O 120.273 0.082 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.1 t -57.7 -45.34 86.75 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.96 -51.18 25.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 123.686 0.66 . . . . 0.0 112.226 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.54 -50.96 65.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.97 0.908 . . . . 0.0 110.85 -178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.63 79.06 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.534 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 66.3 mmm -55.13 -47.41 75.09 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.075 0.95 . . . . 0.0 110.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.57 -53.29 3.61 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.212 1.387 . . . . 0.0 111.472 170.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -66.08 -55.05 18.46 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -75.29 -34.58 61.32 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -168.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -133.32 -56.59 0.91 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.422 1.089 . . . . 0.0 110.864 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.67 152.54 6.93 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 107.609 -2.197 . . . . 0.0 107.609 -170.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.05 65.77 5.32 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.169 0.985 . . . . 0.0 111.71 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -92.04 177.91 6.03 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.99 -1.855 . . . . 0.0 105.99 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 70.81 21.35 5.18 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.041 0.937 . . . . 0.0 112.882 168.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.3 m -75.01 73.06 2.19 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 169.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 72.41 -69.62 0.18 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 126.517 1.927 . . . . 0.0 112.312 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -46.4 -60.41 2.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.834 1.254 . . . . 0.0 112.159 -168.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.5 m -60.5 -31.55 70.58 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.605 0.762 . . . . 0.0 112.595 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -73.89 -40.8 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 119.013 0.824 . . . . 0.0 109.626 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.0 t -58.94 -53.59 56.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 171.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -58.29 -42.64 87.04 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.486 0.715 . . . . 0.0 111.261 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.1 -62.36 1.68 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 124.294 1.038 . . . . 0.0 109.95 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -62.7 -35.89 81.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.507 -174.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.63 -8.68 44.29 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.43 40.08 27.6 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.998 1.319 . . . . 0.0 110.559 -173.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -79.8 -32.79 40.79 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.574 0.75 . . . . 0.0 110.361 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 mt -81.24 45.19 0.83 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.556 0.742 . . . . 0.0 110.828 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.6 m -15.54 77.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 130.311 3.444 . . . . 0.0 116.763 -169.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.0 t80 69.22 -57.11 0.53 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.501 1.92 . . . . 0.0 114.249 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -39.04 -55.61 1.55 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.712 2.005 . . . . 0.0 113.363 -174.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -73.85 -52.67 12.24 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 122.07 0.938 . . . . 0.0 108.601 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.8 mtp -48.37 -38.57 19.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.537 1.535 . . . . 0.0 113.593 -170.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.78 -30.39 71.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -83.14 -42.28 17.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.607 0.718 . . . . 0.0 109.459 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.262 0.1 OUTLIER -62.86 -37.94 88.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.608 0.763 . . . . 0.0 112.407 -172.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -54.6 -67.21 0.7 Allowed Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.959 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.45 -41.58 74.65 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.328 2.019 . . . . 0.0 111.421 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.26 -49.86 51.92 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.935 0.494 . . . . 0.0 111.274 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 mt -67.65 -42.66 81.9 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 118.953 0.797 . . . . 0.0 111.77 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -55.52 -48.55 74.48 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -62.9 -44.78 95.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.762 0.425 . . . . 0.0 110.843 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -52.53 -49.41 64.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.429 0.559 . . . . 0.0 110.264 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.4 -47.78 77.88 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.986 0.914 . . . . 0.0 109.012 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -50.86 -56.75 10.77 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.134 0.492 . . . . 0.0 110.547 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -60.4 -42.96 97.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.52 0.728 . . . . 0.0 110.217 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.415 0 C-N-CA 124.133 0.973 . . . . 0.0 111.187 174.836 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -57.06 -57.08 14.14 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.66 -38.81 92.52 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 119.717 -0.182 . . . . 0.0 111.297 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.8 mt -58.48 -44.79 89.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.073 173.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.88 -52.18 64.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.197 0.908 . . . . 0.0 108.932 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.46 -53.89 48.15 Favored 'General case' 0 CA--C 1.529 0.135 0 O-C-N 122.146 -0.346 . . . . 0.0 110.147 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -52.08 -49.13 64.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.945 1.298 . . . . 0.0 110.351 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.53 -51.87 68.05 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.309 0.644 . . . . 0.0 111.173 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -57.21 -45.77 83.53 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.721 0.772 . . . . 0.0 110.005 175.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 m -61.01 -31.51 71.13 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.73 -0.606 . . . . 0.0 110.164 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -62.24 -28.96 70.06 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.308 -0.87 . . . . 0.0 110.987 175.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -65.48 -50.54 64.97 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 121.406 -0.809 . . . . 0.0 110.016 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -58.65 -40.88 84.73 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.954 -0.466 . . . . 0.0 110.496 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.4 mtm180 -67.28 -43.49 81.65 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.401 0.68 . . . . 0.0 110.862 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 42.9 mtm180 -49.27 -55.56 12.27 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.08 0.855 . . . . 0.0 109.895 169.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.72 -50.77 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -54.54 -44.6 73.0 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.249 0.62 . . . . 0.0 111.48 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.0 -9.19 58.03 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.04 29.29 74.37 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.067 0.849 . . . . 0.0 111.124 -171.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 N--CA 1.455 -0.188 0 C-N-CA 124.591 1.156 . . . . 0.0 109.821 176.244 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 44.9 t0 . . . . . 0 CA--C 1.531 0.212 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.08 -48.47 78.92 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 171.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.67 -54.59 8.87 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.781 0.705 . . . . 0.0 111.423 173.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 tp -60.4 -54.85 40.69 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.645 0.778 . . . . 0.0 111.054 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.13 -47.14 84.21 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.758 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -43.6 83.79 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.84 -0.537 . . . . 0.0 109.962 173.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.93 -55.7 6.22 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.827 1.203 . . . . 0.0 111.35 169.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.26 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.8 mt -85.66 -25.02 26.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -169.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -143.88 -64.52 0.37 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.117 1.367 . . . . 0.0 110.72 -174.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.97 143.06 3.71 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -171.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.18 71.95 8.18 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -172.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -107.48 26.91 9.67 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.528 0.731 . . . . 0.0 111.865 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -142.75 21.95 1.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -169.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 59.2 m -68.85 84.88 0.32 Allowed 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 169.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.282 4.2 pm0 58.25 -62.89 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 129.507 3.123 . . . . 0.0 113.806 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.3 m -33.46 -70.72 0.07 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.092 2.557 . . . . 0.0 112.953 -175.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 m -59.27 -38.76 80.89 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.091 1.357 . . . . 0.0 112.408 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.38 -35.51 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 122.977 0.511 . . . . 0.0 110.086 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -65.94 -50.41 64.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -56.25 -36.9 69.07 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.745 0.818 . . . . 0.0 111.278 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -60.36 -59.53 5.25 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.865 0.866 . . . . 0.0 110.054 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -56.42 -41.17 75.93 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.499 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.36 -3.45 24.06 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . 0.289 0.6 OUTLIER 40.56 51.82 2.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 127.236 2.214 . . . . 0.0 113.175 -170.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -79.39 -43.79 22.73 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.384 1.074 . . . . 0.0 110.838 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -80.22 58.65 3.1 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.699 0.8 . . . . 0.0 110.623 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.1 m -27.56 91.97 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 129.262 3.025 . . . . 0.0 116.121 -171.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 53.2 t80 67.49 -58.68 0.42 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.252 2.221 . . . . 0.0 114.63 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -44.13 -50.55 8.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.571 1.548 . . . . 0.0 112.56 -173.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.4 -54.51 12.13 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.694 0.759 . . . . 0.0 109.287 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.02 -43.41 19.53 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.669 1.588 . . . . 0.0 112.478 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.46 -32.36 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -83.5 -44.02 15.15 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.721 0.772 . . . . 0.0 109.262 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.5 tp -57.42 -42.16 81.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.278 1.031 . . . . 0.0 112.099 -176.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -58.68 -61.51 7.55 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.41 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -58.95 -38.77 86.28 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.721 1.614 . . . . 0.0 111.251 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tt -53.14 -54.13 40.28 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.865 0.757 . . . . 0.0 111.402 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.79 -39.12 87.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.797 0.439 . . . . 0.0 111.333 177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -58.69 -47.35 84.81 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.547 0.612 . . . . 0.0 109.856 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -64.31 -45.69 86.85 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.09 0.556 . . . . 0.0 110.143 177.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -50.95 -48.02 60.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.645 0.26 . . . . 0.0 110.425 173.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -51.41 69.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.422 1.089 . . . . 0.0 109.426 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -45.69 77.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.99 -54.6 35.76 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -178.191 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 C--O 1.227 -0.127 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.77 -39.65 52.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.563 0.745 . . . . 0.0 111.687 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -79.52 -48.08 14.48 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -53.13 -46.99 69.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.462 0.705 . . . . 0.0 111.71 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.09 -60.06 4.15 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.069 0.85 . . . . 0.0 111.658 -176.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -48.29 -52.05 23.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.862 175.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -54.46 -51.23 65.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.034 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.23 -52.71 63.45 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.84 0.746 . . . . 0.0 110.69 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -57.04 -46.41 82.44 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.574 0.702 . . . . 0.0 110.711 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.5 m -60.56 -39.76 89.13 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 123.112 0.565 . . . . 0.0 110.274 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -58.62 -49.15 78.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.934 0.893 . . . . 0.0 109.196 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -56.49 -52.74 63.59 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 122.446 -0.159 . . . . 0.0 110.908 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -52.74 -53.48 47.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.779 0.432 . . . . 0.0 110.666 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -54.63 -54.01 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.77 0.828 . . . . 0.0 110.187 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.0 ptt85 -63.19 -36.8 84.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.987 -0.446 . . . . 0.0 110.985 -174.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 73.8 mt -55.2 -56.03 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 170.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -55.13 -41.31 71.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.131 0.423 . . . . 0.0 111.683 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.6 mt -73.1 -14.7 61.44 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.76 20.61 77.59 Favored Glycine 0 CA--C 1.533 1.157 0 O-C-N 121.343 -0.848 . . . . 0.0 111.368 -170.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 122.481 1.134 . . . . 0.0 109.272 -176.41 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 CA--C 1.53 0.174 0 CA-C-O 120.586 0.232 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.0 t -58.23 -50.37 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -177.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -53.76 10.84 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 175.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.18 -52.82 52.62 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.545 0.738 . . . . 0.0 111.018 -174.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.82 -47.71 83.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.455 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.57 85.41 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 121.978 -0.451 . . . . 0.0 109.916 173.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.72 -56.55 4.97 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 125.218 1.39 . . . . 0.0 111.131 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -61.88 -51.77 66.83 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 87.5 mt -77.12 -29.11 54.61 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -168.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -143.51 -63.34 0.4 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.491 1.517 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.12 145.75 4.74 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.63 71.08 7.49 Favored 'General case' 0 N--CA 1.461 0.115 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -172.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -107.69 19.96 19.46 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.597 0.759 . . . . 0.0 111.9 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -143.63 33.02 1.28 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -168.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.4 m -72.2 75.05 0.97 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 169.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 68.07 -62.22 0.36 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 127.589 2.356 . . . . 0.0 112.765 172.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -30.33 -77.85 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 128.319 2.648 . . . . 0.0 113.104 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 m -55.62 -38.21 69.2 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.791 0.836 . . . . 0.0 111.938 -174.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -66.74 -44.43 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 m -57.59 -43.71 84.86 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.065 -1.022 . . . . 0.0 109.629 172.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -64.57 -33.06 75.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.184 0.993 . . . . 0.0 111.901 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -63.37 -53.66 49.09 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 109.659 172.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -37.23 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.81 -14.92 63.21 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.057 -0.402 . . . . 0.0 111.827 171.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.0 mt 59.59 42.96 16.51 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.611 1.964 . . . . 0.0 111.604 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -78.5 -31.62 47.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.836 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.78 5.12 0.23 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -169.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.6 m 40.4 58.94 2.19 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.073 1.749 . . . . 0.0 114.549 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.2 t80 68.41 -58.08 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.008 2.123 . . . . 0.0 114.529 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -47.14 -51.45 18.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.864 1.266 . . . . 0.0 112.885 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.2 -43.38 42.69 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.8 mtt -46.82 -45.24 19.98 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 124.54 1.136 . . . . 0.0 111.421 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 t -60.83 -29.31 69.41 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -177.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -83.09 -45.98 13.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.993 0.902 . . . . 0.0 109.387 171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -56.04 -44.28 78.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.932 1.693 . . . . 0.0 111.963 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -60.95 -59.92 12.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.516 -0.755 . . . . 0.0 111.785 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -58.6 -41.21 66.54 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.421 1.414 . . . . 0.0 111.217 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -49.99 -54.35 20.61 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 175.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.7 mt -68.93 -35.31 76.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.773 -0.579 . . . . 0.0 111.565 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -56.66 -50.05 73.23 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.409 0.55 . . . . 0.0 109.597 174.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -60.5 -49.04 79.14 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.921 0.489 . . . . 0.0 110.02 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 67.6 t90 -49.23 -50.01 40.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.033 0.379 . . . . 0.0 111.009 174.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -48.48 75.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -175.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.32 -42.64 74.01 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 123.075 0.55 . . . . 0.0 111.139 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.52 -51.35 57.59 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.423 0.289 . . . . 0.0 111.116 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 123.735 0.814 . . . . 0.0 112.163 -169.759 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 55.5 mp0 -49.54 -40.12 36.97 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.566 1.546 . . . . 0.0 111.594 175.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.97 -49.98 14.24 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.9 mt -59.25 -44.88 92.36 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.885 0.474 . . . . 0.0 111.593 -172.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -64.86 -56.78 11.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.237 0.542 . . . . 0.0 111.0 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -48.46 -54.55 13.76 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.892 1.277 . . . . 0.0 110.293 172.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -51.45 -53.14 40.11 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.62 -52.1 60.96 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.548 0.339 . . . . 0.0 110.654 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -61.5 -28.38 69.26 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.584 -0.697 . . . . 0.0 111.84 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.3 m -69.76 -43.59 71.93 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.017 -1.052 . . . . 0.0 108.968 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.48 -42.04 81.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.553 0.741 . . . . 0.0 109.829 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -55.25 -56.25 22.09 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.027 -0.42 . . . . 0.0 110.113 172.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.71 -45.53 81.79 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.929 -0.482 . . . . 0.0 111.07 -178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -53.24 -53.75 46.2 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.196 0.598 . . . . 0.0 110.105 174.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.2 mtm105 -53.62 -55.89 21.93 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.445 0.298 . . . . 0.0 110.817 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.1 mm -51.7 -51.68 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.992 0.917 . . . . 0.0 109.111 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.55 -40.5 71.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.392 0.277 . . . . 0.0 111.363 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.6 mt -86.57 -2.32 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.53 25.07 71.33 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 121.092 -1.005 . . . . 0.0 112.6 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -178.33 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -55.5 -45.7 78.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.97 -49.89 28.38 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 123.302 0.477 . . . . 0.0 112.762 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.26 -56.15 23.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.312 0.645 . . . . 0.0 109.925 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.07 -54.58 37.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.945 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 80.1 mmm -54.69 -44.19 73.15 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.714 1.206 . . . . 0.0 110.468 174.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -42.95 -56.09 4.59 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 125.328 1.442 . . . . 0.0 111.566 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.92 -49.85 64.25 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.765 0.283 . . . . 0.0 111.724 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.76 -34.56 64.77 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.434 ' HH ' ' HZ1' ' A' ' 69' ' ' LYS . 98.3 m-85 -134.78 -59.61 0.8 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.472 1.109 . . . . 0.0 110.93 -172.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.47 146.24 4.61 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 -171.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -81.89 69.59 8.61 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 117.646 0.723 . . . . 0.0 111.422 -169.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -106.41 -155.05 0.53 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 165.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 66.43 -82.13 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.975 0.91 . . . . 0.0 110.61 168.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m 45.05 -72.94 0.0 OUTLIER 'General case' 0 C--N 1.339 0.126 0 C-N-CA 130.011 3.324 . . . . 0.0 115.432 172.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -159.14 -50.33 0.06 Allowed 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.9 p -56.37 -72.28 0.08 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.244 1.017 . . . . 0.0 110.735 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.3 m -55.9 -37.55 69.04 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.494 0.718 . . . . 0.0 111.217 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.75 -42.68 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.618 -0.676 . . . . 0.0 111.871 172.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.4 m -65.23 -43.26 92.01 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.487 -0.758 . . . . 0.0 110.517 173.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -54.69 -47.4 73.72 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.609 0.64 . . . . 0.0 110.456 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -55.75 -59.18 5.23 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.898 1.279 . . . . 0.0 110.439 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -55.09 -38.17 67.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.1 0.96 . . . . 0.0 112.508 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.03 -8.95 58.85 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.254 1.022 . . . . 0.0 112.625 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 58.05 47.79 14.16 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.273 1.429 . . . . 0.0 110.784 -175.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.01 -47.91 15.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.052 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.14 96.57 1.09 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.9 p -68.12 81.55 0.22 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.565 0.746 . . . . 0.0 111.039 -174.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 78.4 t80 75.53 -48.56 0.61 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.97 2.108 . . . . 0.0 113.341 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -35.78 -61.52 0.47 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.504 1.922 . . . . 0.0 112.415 -169.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -79.78 -44.77 20.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.779 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.7 mtp -42.7 -45.52 4.75 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 125.028 1.331 . . . . 0.0 112.094 -174.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.1 t -60.64 -34.07 73.73 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -79.03 -44.47 22.15 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.082 0.944 . . . . 0.0 109.36 174.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -35.1 75.32 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.056 1.342 . . . . 0.0 113.406 -170.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -58.69 -61.62 7.33 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-O 117.769 -1.11 . . . . 0.0 112.395 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -58.74 -40.15 75.53 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.676 1.584 . . . . 0.0 110.982 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -51.66 -52.51 47.47 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.099 0.96 . . . . 0.0 111.387 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.1 mt -71.24 -33.89 70.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.558 -0.714 . . . . 0.0 111.525 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -57.68 -47.23 82.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HZ1' ' HH ' ' A' ' 38' ' ' TYR . 6.3 mtpm? -59.01 -47.83 83.78 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 177.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -51.11 -47.82 61.85 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.913 0.324 . . . . 0.0 110.565 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.49 94.68 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -41.08 81.06 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.878 0.471 . . . . 0.0 110.259 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -68.16 -52.66 32.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.919 0.39 . . . . 0.0 110.442 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.2 0 C-N-CA 124.328 1.051 . . . . 0.0 112.23 -171.326 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -52.09 -42.4 63.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.432 0.693 . . . . 0.0 111.197 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -37.92 62.64 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.846 -0.534 . . . . 0.0 109.82 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.55 -46.36 89.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.445 -0.788 . . . . 0.0 111.476 178.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -58.77 -58.49 8.36 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.77 1.168 . . . . 0.0 111.175 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -46.22 -54.41 8.83 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.707 0.803 . . . . 0.0 110.189 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.24 -49.96 65.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.461 1.105 . . . . 0.0 111.087 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.23 -53.77 54.35 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.521 0.6 . . . . 0.0 110.496 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -56.91 -43.04 80.98 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.314 0.578 . . . . 0.0 110.751 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.2 m -60.99 -48.01 83.82 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -54.7 -47.29 73.88 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.379 0.672 . . . . 0.0 110.052 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.44 -47.36 82.01 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.204 0.456 . . . . 0.0 111.276 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.81 -44.78 82.32 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.903 -0.498 . . . . 0.0 111.001 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.4 mmt-85 -59.59 -46.15 89.8 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.607 0.639 . . . . 0.0 110.883 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -54.7 -46.99 74.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.34 0.656 . . . . 0.0 110.596 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt -61.26 -50.15 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.348 0.659 . . . . 0.0 109.812 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -47.44 67.36 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.822 0.849 . . . . 0.0 110.329 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -67.42 -12.97 61.55 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.751 0.82 . . . . 0.0 112.353 178.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.33 33.87 86.25 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.999 0.904 . . . . 0.0 108.972 -175.039 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 120.461 0.172 . . . . 0.0 110.603 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -51.44 -46.48 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 172.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -55.47 -45.81 82.79 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 118.109 0.413 . . . . 0.0 112.517 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.99 -51.64 66.07 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 121.643 0.735 . . . . 0.0 110.41 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.1 85.51 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.752 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -42.23 80.3 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 124.097 0.959 . . . . 0.0 109.841 172.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -56.91 5.71 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 125.358 1.456 . . . . 0.0 111.154 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.65 -51.12 70.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.74 0.27 . . . . 0.0 111.615 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 mt -81.59 -25.21 35.93 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 115.135 1.531 . . . . 0.0 115.135 -168.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -143.31 -63.11 0.4 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.772 1.229 . . . . 0.0 111.133 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.27 145.28 5.18 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.79 56.5 3.08 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 117.839 0.82 . . . . 0.0 112.51 -167.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -88.6 -175.74 5.04 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 168.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 68.51 40.41 1.94 Allowed 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.972 -1.08 . . . . 0.0 112.634 169.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.3 p -74.96 52.5 0.55 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.965 1.306 . . . . 0.0 109.906 171.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 64.88 -44.86 0.33 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.541 1.936 . . . . 0.0 113.532 -169.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.1 p -44.12 -68.48 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.529 1.932 . . . . 0.0 111.864 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -35.54 73.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.843 0.857 . . . . 0.0 111.323 -174.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.0 mm -64.41 -46.67 92.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.257 0.623 . . . . 0.0 109.507 174.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.1 m -56.52 -45.6 81.0 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.983 -1.073 . . . . 0.0 110.22 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -57.04 -41.48 78.74 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.064 -0.397 . . . . 0.0 111.572 174.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -58.26 -52.61 64.86 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 122.973 0.509 . . . . 0.0 110.298 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.33 -27.47 69.05 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.8 -8.19 56.85 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.573 0.624 . . . . 0.0 111.87 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.31 42.14 25.38 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.987 1.715 . . . . 0.0 110.352 -171.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -79.77 -38.14 33.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.653 -173.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 mt -80.45 56.12 2.47 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.948 0.899 . . . . 0.0 112.873 -169.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.2 m 21.7 53.57 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 130.861 3.664 . . . . 0.0 116.94 169.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.1 t80 65.25 -57.32 0.3 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.321 2.249 . . . . 0.0 114.016 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -38.95 -53.09 1.77 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.447 1.899 . . . . 0.0 113.235 -175.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -72.7 -58.02 3.67 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.501 0.667 . . . . 0.0 109.217 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.3 mtp -44.1 -44.79 7.78 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.724 2.01 . . . . 0.0 112.256 -173.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.33 -31.62 72.9 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.811 0.845 . . . . 0.0 112.613 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -82.16 -37.83 25.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 171.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.071 0.948 . . . . 0.0 110.983 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -51.25 -68.32 0.4 Allowed Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.645 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.33 -37.63 94.22 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.862 1.708 . . . . 0.0 111.524 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -53.63 -54.06 43.01 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.678 0.672 . . . . 0.0 111.293 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 57.0 mt -67.65 -37.96 83.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 121.851 -0.531 . . . . 0.0 111.241 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -57.09 -49.97 74.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.349 0.522 . . . . 0.0 109.856 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -66.43 -42.61 87.43 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 122.246 -0.284 . . . . 0.0 110.482 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -50.59 -49.45 56.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.965 0.348 . . . . 0.0 110.173 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.24 -50.68 69.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -178.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -39.71 61.89 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.637 0.775 . . . . 0.0 111.15 178.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -71.82 -52.41 17.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 117.859 0.3 . . . . 0.0 110.82 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.151 0.98 . . . . 0.0 112.354 -170.86 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp . . . . . 0 CA--C 1.533 0.29 0 N-CA-C 110.709 -0.108 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -49.87 -44.78 50.04 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.328 1.451 . . . . 0.0 111.776 174.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.01 -51.58 37.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.0 mt -53.4 -48.83 68.32 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.787 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -59.27 -61.65 2.47 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.066 0.848 . . . . 0.0 111.247 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -50.62 -52.69 37.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.725 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.52 -50.45 65.42 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.131 0.572 . . . . 0.0 111.1 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -53.1 61.77 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.393 0.677 . . . . 0.0 110.899 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -55.11 -47.02 75.58 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.319 0.58 . . . . 0.0 109.804 177.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.8 m -62.72 -39.09 92.96 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 123.238 0.615 . . . . 0.0 110.579 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -60.02 -51.39 69.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.208 1.003 . . . . 0.0 108.885 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -56.7 -53.69 54.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.398 0.279 . . . . 0.0 110.814 175.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.45 -52.64 53.06 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.662 -0.649 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -62.55 -48.06 81.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.371 0.668 . . . . 0.0 110.761 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 -57.64 -44.15 85.4 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.67 0.668 . . . . 0.0 109.451 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 84.9 mt -59.19 -47.76 89.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 O-C-N 122.081 -0.387 . . . . 0.0 110.003 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -56.36 -40.24 74.19 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.65 0.659 . . . . 0.0 111.503 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.2 mt -72.68 -1.39 16.12 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.48 25.49 74.11 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 121.236 -0.915 . . . . 0.0 111.664 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 . . . . . 0 N--CA 1.452 -0.335 0 C-N-CA 123.871 0.868 . . . . 0.0 108.879 -178.701 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 t70 . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.7 t -58.09 -56.05 18.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.68 -49.05 12.53 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-N 118.095 0.407 . . . . 0.0 112.25 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.88 -52.56 65.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.709 1.204 . . . . 0.0 110.049 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.59 -47.72 78.94 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.844 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 48.3 mmm -56.15 -46.31 79.31 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 121.695 -0.628 . . . . 0.0 109.637 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -41.49 -56.65 3.45 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 125.546 1.545 . . . . 0.0 111.662 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -65.36 -50.41 65.65 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.361 0.665 . . . . 0.0 111.801 -178.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.89 -48.18 66.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.163 0.438 . . . . 0.0 111.959 -174.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.41 -56.09 1.42 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.246 1.019 . . . . 0.0 111.154 -169.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.28 152.53 6.29 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 107.934 -2.066 . . . . 0.0 107.934 -169.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -81.02 54.35 2.19 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.887 -0.773 . . . . 0.0 111.076 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.69 -15.1 61.24 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.885 -0.51 . . . . 0.0 111.501 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.78 43.8 1.74 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.104 1.762 . . . . 0.0 107.725 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.6 p -61.65 -62.8 1.55 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.838 0.855 . . . . 0.0 110.349 -169.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.453 ' NE2' ' H ' ' A' ' 45' ' ' THR . 0.2 OUTLIER -161.48 -55.31 0.05 OUTLIER 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.199 0.599 . . . . 0.0 112.226 178.688 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.453 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -57.96 -52.93 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.407 1.083 . . . . 0.0 109.423 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 p -55.03 -51.53 66.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.184 0.994 . . . . 0.0 111.67 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -59.39 -46.98 92.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 O-C-N 122.02 -0.425 . . . . 0.0 110.71 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.0 m -56.43 -50.5 71.47 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.938 0.875 . . . . 0.0 110.77 175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -62.03 -30.1 70.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.765 1.226 . . . . 0.0 111.454 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -61.23 -57.4 12.56 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.176 0.591 . . . . 0.0 109.796 173.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.07 -30.52 68.13 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.61 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.34 -7.45 59.07 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.05 36.95 13.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.14 1.776 . . . . 0.0 112.106 -171.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -80.19 -31.57 38.74 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.844 -0.535 . . . . 0.0 111.861 -175.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -79.11 53.53 1.46 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.718 0.807 . . . . 0.0 111.554 -175.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.7 m -5.23 71.57 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 130.407 3.483 . . . . 0.0 116.49 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.7 t80 66.64 -57.81 0.39 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.938 2.095 . . . . 0.0 114.262 174.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.8 -55.56 3.6 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.517 1.527 . . . . 0.0 113.734 -169.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.18 -46.92 39.05 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 57.4 mtp -50.82 -42.11 58.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.342 1.457 . . . . 0.0 111.273 -173.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.4 t -64.36 -28.42 69.69 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.782 0.833 . . . . 0.0 112.663 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -82.7 -45.06 14.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.863 0.839 . . . . 0.0 109.425 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.267 0.1 OUTLIER -59.84 -46.92 87.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.819 1.247 . . . . 0.0 112.609 -178.249 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -55.12 -58.3 15.55 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -59.73 -34.81 95.96 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.848 1.698 . . . . 0.0 111.488 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 mp -63.69 -45.35 90.45 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 19.1 mt -62.9 -39.63 95.11 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 173.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.64 -50.37 74.1 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.899 0.772 . . . . 0.0 109.361 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.65 -47.8 81.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.358 0.663 . . . . 0.0 110.27 175.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -53.02 -43.45 66.56 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 122.228 -0.295 . . . . 0.0 110.487 174.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.88 -46.78 80.32 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -39.64 73.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.028 0.531 . . . . 0.0 110.611 176.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.52 -58.1 4.06 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.94 0.496 . . . . 0.0 111.537 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.151 0 C-N-CA 124.601 1.16 . . . . 0.0 112.158 -169.896 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 C--O 1.226 -0.155 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.4 mp0 -49.84 -45.43 50.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.198 1.399 . . . . 0.0 111.05 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.21 -48.36 57.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -55.79 -54.04 49.26 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.414 0.686 . . . . 0.0 111.444 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.04 -56.59 20.24 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-N 119.027 0.831 . . . . 0.0 111.137 -177.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.38 -54.88 18.5 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -54.21 -48.96 70.45 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.904 0.482 . . . . 0.0 110.744 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -52.37 65.81 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.142 0.977 . . . . 0.0 111.066 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -59.42 -46.97 87.21 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.627 -0.67 . . . . 0.0 110.122 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.8 m -60.71 -38.42 84.99 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 122.022 -0.423 . . . . 0.0 110.129 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.39 -46.28 90.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.847 0.859 . . . . 0.0 109.171 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -56.21 -50.67 70.6 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.266 0.484 . . . . 0.0 110.444 174.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -56.86 -48.5 77.97 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.162 -0.961 . . . . 0.0 110.885 178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -57.55 -42.37 82.84 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.934 -0.479 . . . . 0.0 111.061 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -54.64 -49.08 71.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.489 1.115 . . . . 0.0 110.349 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.2 mm -61.71 -48.82 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.233 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.95 -44.43 87.0 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.259 0.481 . . . . 0.0 111.389 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.2 mt -64.43 -37.98 89.44 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.255 0.622 . . . . 0.0 110.35 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.55 34.36 6.08 Favored Glycine 0 CA--C 1.525 0.719 0 C-N-CA 124.369 0.985 . . . . 0.0 111.348 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 122.938 1.351 . . . . 0.0 108.258 173.043 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.1 t70 . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.0 t -42.42 -43.46 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 124.28 1.032 . . . . 0.0 109.259 167.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.42 -45.63 16.68 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.125 0.869 . . . . 0.0 113.566 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.6 tp -70.07 -52.79 21.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.725 0.774 . . . . 0.0 109.87 -176.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.97 80.99 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.386 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.7 mmm -53.92 -47.3 71.33 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 110.318 170.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.48 -54.2 3.38 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 125.308 1.432 . . . . 0.0 111.461 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.62 -53.14 37.41 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 mt -76.15 -31.94 58.83 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -168.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -135.63 -56.69 0.79 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.461 1.105 . . . . 0.0 110.52 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.83 156.17 8.63 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -170.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.66 74.12 5.2 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.839 0.82 . . . . 0.0 110.489 -169.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -109.38 159.91 16.61 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 73.74 33.88 0.98 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.509 1.123 . . . . 0.0 113.771 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.4 m -75.05 65.29 1.45 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 64.05 -59.15 0.2 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.163 2.185 . . . . 0.0 112.5 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.1 p -32.19 -66.28 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.002 1.721 . . . . 0.0 113.081 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.17 -30.93 71.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.922 0.889 . . . . 0.0 112.383 -177.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 26.0 mm -67.15 -49.06 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.2 m -52.45 -53.61 43.18 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.579 -0.701 . . . . 0.0 110.373 173.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -59.36 -37.81 78.82 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.616 0.766 . . . . 0.0 111.364 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -61.37 -60.3 3.93 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.268 0.627 . . . . 0.0 110.039 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.26 -41.59 76.05 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.12 -11.98 58.7 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 55.39 46.59 23.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.303 1.441 . . . . 0.0 110.911 -173.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -79.92 -41.12 26.73 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.439 1.095 . . . . 0.0 110.929 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.3 mt -77.91 -162.23 0.31 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.3 m -154.73 173.29 16.62 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 120.772 -1.205 . . . . 0.0 109.104 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -41.53 0.86 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.07 2.548 . . . . 0.0 112.07 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -39.61 -39.48 0.75 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.131 1.372 . . . . 0.0 112.023 176.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -104.75 -56.02 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.685 1.594 . . . . 0.0 109.743 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.0 mtt -47.15 -39.52 13.8 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.128 1.771 . . . . 0.0 113.945 -170.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.0 t -66.42 -25.31 66.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -90.03 -40.28 12.41 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -43.23 77.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.332 0.653 . . . . 0.0 111.814 -178.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -54.02 -65.77 1.12 Allowed Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 118.978 -0.534 . . . . 0.0 112.216 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -58.78 -40.75 69.69 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.891 1.728 . . . . 0.0 111.655 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 tt -49.19 -51.99 29.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 111.172 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.55 -40.21 80.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 121.775 -0.578 . . . . 0.0 111.275 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -61.68 -44.7 96.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.453 1.024 . . . . 0.0 110.259 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -61.65 -46.67 88.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.716 -0.615 . . . . 0.0 109.812 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -50.79 -46.58 59.7 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.791 0.269 . . . . 0.0 110.32 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.75 -48.85 79.93 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.761 0.824 . . . . 0.0 109.239 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.25 -48.82 77.88 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -57.6 -48.57 79.03 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.15 0.58 . . . . 0.0 109.64 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 C-N-CA 124.61 1.164 . . . . 0.0 110.993 176.59 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.484 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -45.67 -47.53 15.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.241 1.416 . . . . 0.0 112.003 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -74.32 -49.66 21.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.73 -48.99 71.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.366 0.667 . . . . 0.0 111.496 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -61.19 -61.13 2.78 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.615 0.643 . . . . 0.0 110.843 -178.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -51.38 -48.28 62.61 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.413 0.685 . . . . 0.0 110.509 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -54.72 -51.83 64.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.763 0.425 . . . . 0.0 110.48 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.38 -52.83 58.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.35 0.523 . . . . 0.0 111.274 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -54.5 -46.45 73.47 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.896 0.379 . . . . 0.0 110.017 177.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.0 m -59.75 -42.54 93.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.821 0.449 . . . . 0.0 110.383 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -60.64 -44.87 95.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.844 0.458 . . . . 0.0 109.917 177.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -59.3 -48.92 79.81 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.724 -0.61 . . . . 0.0 111.079 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -55.45 -50.26 70.31 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.249 0.62 . . . . 0.0 110.141 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -52.01 -55.63 19.31 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.373 173.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -53.19 -49.27 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 110.439 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.1 mt -60.39 -44.94 97.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.539 0.736 . . . . 0.0 110.128 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -57.92 -41.37 82.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.749 0.704 . . . . 0.0 111.075 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.09 -10.81 59.95 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 173.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.15 73.88 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 123.623 0.769 . . . . 0.0 109.901 -176.692 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 CA--C 1.531 0.227 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.2 t -55.66 -41.02 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.9 -52.77 24.81 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.097 0.856 . . . . 0.0 112.993 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 tp -72.32 -47.52 49.1 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 117.997 0.898 . . . . 0.0 110.639 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.63 -51.71 64.55 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.288 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 62.4 mtp -64.56 -37.6 88.11 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 121.895 -0.503 . . . . 0.0 110.699 170.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -37.83 -56.75 1.68 Allowed Glycine 0 C--O 1.229 -0.206 0 C-N-CA 126.083 1.801 . . . . 0.0 111.262 172.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -76.1 -45.94 31.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.6 tp -72.02 -16.49 62.06 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -170.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -153.81 -64.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.856 1.662 . . . . 0.0 111.097 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.94 149.08 6.03 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 -169.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.93 67.77 8.05 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 117.746 0.773 . . . . 0.0 111.137 -168.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -121.76 170.73 9.46 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.501 1.52 . . . . 0.0 107.53 171.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 62.26 45.06 7.07 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.305 1.042 . . . . 0.0 111.44 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -62.53 -59.09 5.44 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.2 1.0 . . . . 0.0 109.072 169.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.59 -51.38 0.06 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.64 1.576 . . . . 0.0 108.849 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.9 p -50.63 -58.67 5.3 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.353 1.061 . . . . 0.0 111.742 -175.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.38 78.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.7 1.2 . . . . 0.0 111.1 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.8 mm -63.82 -56.54 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.799 0.84 . . . . 0.0 109.239 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.9 m -50.33 -45.38 54.82 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.215 -0.928 . . . . 0.0 111.275 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -60.8 -37.48 82.09 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -59.0 -55.49 34.46 Favored 'General case' 0 CA--C 1.522 -0.114 0 CA-C-N 118.71 0.687 . . . . 0.0 109.699 172.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.04 -31.46 70.0 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.8 -2.57 40.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.177 0.591 . . . . 0.0 112.421 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mp 53.52 35.75 21.59 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.88 1.672 . . . . 0.0 112.252 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -31.53 50.83 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.99 39.68 0.51 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.961 0.904 . . . . 0.0 109.937 176.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.8 m -37.83 94.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 128.864 2.866 . . . . 0.0 115.567 -167.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.9 t80 69.2 -56.89 0.54 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 128.197 2.599 . . . . 0.0 113.63 173.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -39.72 -51.6 2.33 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.535 1.934 . . . . 0.0 112.83 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -47.53 14.98 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.7 mtt -44.24 -40.09 4.91 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.458 1.903 . . . . 0.0 112.847 -169.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 24.2 t -65.07 -25.97 68.04 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 118.473 -1.291 . . . . 0.0 112.912 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -90.17 -45.16 9.28 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 169.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -42.28 79.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 125.143 1.377 . . . . 0.0 112.476 -174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.6 -62.0 6.83 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.362 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.96 -38.35 92.5 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.342 1.361 . . . . 0.0 111.735 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.31 -55.49 27.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.642 0.777 . . . . 0.0 111.449 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.38 -37.45 83.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 121.074 -1.016 . . . . 0.0 111.254 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -58.5 -47.85 82.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.594 -0.691 . . . . 0.0 109.276 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -61.55 -44.05 97.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.359 0.663 . . . . 0.0 110.085 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.7 t90 -52.49 -49.29 65.02 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.769 0.713 . . . . 0.0 110.563 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.25 -48.55 77.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.549 0.74 . . . . 0.0 109.427 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -56.55 -45.13 81.4 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 122.687 0.395 . . . . 0.0 110.654 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.67 -47.55 85.74 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.978 0.511 . . . . 0.0 110.86 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.264 0 C-N-CA 123.466 0.706 . . . . 0.0 110.998 -179.743 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt . . . . . 0 CA--C 1.53 0.206 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -50.3 -37.17 35.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.572 1.149 . . . . 0.0 111.875 173.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -83.86 -45.01 13.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.986 0.514 . . . . 0.0 110.381 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.15 -46.87 62.16 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.657 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -57.76 -63.53 1.21 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.133 0.879 . . . . 0.0 111.511 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -55.7 -46.01 77.76 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.551 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.06 -52.41 64.37 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.98 0.512 . . . . 0.0 110.093 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.27 74.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.886 -0.509 . . . . 0.0 109.946 -177.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -56.19 -33.98 65.8 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.969 -0.457 . . . . 0.0 111.569 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.3 m -69.52 -40.43 76.93 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 121.469 -0.769 . . . . 0.0 109.449 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.27 -41.57 84.58 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -57.81 -51.6 68.93 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.97 -0.456 . . . . 0.0 110.814 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -55.57 -48.16 75.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.102 0.561 . . . . 0.0 110.417 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.67 -46.77 86.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.335 0.654 . . . . 0.0 110.771 176.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 mtm105 -55.15 -50.22 69.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.813 -0.554 . . . . 0.0 110.99 174.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.9 mt -54.71 -51.25 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -54.51 -45.36 73.28 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 122.678 0.391 . . . . 0.0 111.358 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 mt -74.16 -17.74 60.87 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.658 0.783 . . . . 0.0 112.368 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.02 32.19 72.99 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.051 0.834 . . . . 0.0 111.07 -170.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 . . . . . 0 N--CA 1.457 -0.117 0 C-N-CA 123.811 0.844 . . . . 0.0 111.088 -173.686 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.3 -48.46 32.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.939 170.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -49.99 17.63 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.275 0.94 . . . . 0.0 112.095 176.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 tp -62.39 -53.35 56.27 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.802 0.841 . . . . 0.0 110.702 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.94 78.12 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.366 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtp -55.39 -43.01 74.8 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 123.768 0.827 . . . . 0.0 110.233 169.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.24 -53.76 6.57 Favored Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.456 1.503 . . . . 0.0 111.73 168.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -62.65 -48.8 77.74 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.409 0.283 . . . . 0.0 111.373 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.65 -48.36 22.44 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -125.12 -62.47 1.22 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.358 1.863 . . . . 0.0 112.952 -168.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.52 138.49 2.73 Favored Glycine 0 CA--C 1.531 1.089 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.52 59.15 4.5 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.506 0.722 . . . . 0.0 111.593 -167.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.57 -20.0 19.34 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -172.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -101.78 78.6 1.83 Allowed 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -166.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.5 t -73.47 171.14 13.7 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 165.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.28 -38.61 42.0 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -54.17 -57.76 9.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.569 1.147 . . . . 0.0 111.854 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -41.49 92.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.62 0.768 . . . . 0.0 110.109 -176.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -59.27 -43.2 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 122.015 -0.428 . . . . 0.0 110.966 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.2 m -59.12 -43.24 91.93 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 118.692 0.678 . . . . 0.0 110.093 174.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -47.87 61.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.611 0.364 . . . . 0.0 110.815 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -62.93 -54.93 30.89 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 122.37 0.268 . . . . 0.0 111.624 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.51 -23.24 66.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.096 0.958 . . . . 0.0 113.11 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.26 -7.62 59.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.844 0.858 . . . . 0.0 111.186 169.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp 52.24 44.34 29.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 126.387 1.875 . . . . 0.0 110.019 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -79.52 -33.58 41.9 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.024 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.5 mt -78.35 46.09 0.6 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.878 0.871 . . . . 0.0 112.621 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.3 t 60.77 -76.59 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.067 2.147 . . . . 0.0 113.179 174.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.1 t80 176.28 -47.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 126.554 1.942 . . . . 0.0 107.795 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -54.03 2.73 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.562 1.545 . . . . 0.0 112.995 -176.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -76.24 -56.45 4.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 37.9 mtp -38.33 -49.04 1.39 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.438 2.295 . . . . 0.0 112.178 -178.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.13 -41.7 84.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.0 0.92 . . . . 0.0 112.589 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -77.68 -34.72 52.81 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.3 0.64 . . . . 0.0 109.902 175.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -50.89 65.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.084 1.353 . . . . 0.0 110.511 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -46.2 -64.14 1.06 Allowed Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.26 -34.82 98.12 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 121.973 1.782 . . . . 0.0 111.837 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.61 -51.99 66.24 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.57 -39.24 90.46 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.652 0.381 . . . . 0.0 111.283 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.15 -51.86 67.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.941 -0.474 . . . . 0.0 110.182 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.14 -43.5 98.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.7 0.4 . . . . 0.0 110.157 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -52.59 -45.29 66.44 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 172.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.11 -46.56 80.53 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.66 -40.92 66.31 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.985 0.514 . . . . 0.0 110.59 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -70.03 -55.3 9.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.769 0.428 . . . . 0.0 111.543 177.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.192 0 C-N-CA 124.17 0.988 . . . . 0.0 112.766 -169.115 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 CA--C 1.527 0.084 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -37.24 -51.75 1.04 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.116 1.366 . . . . 0.0 111.455 174.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.22 -48.73 78.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.795 0.838 . . . . 0.0 110.05 -178.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.42 -48.32 82.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.431 1.092 . . . . 0.0 110.155 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.09 -58.16 9.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.716 0.769 . . . . 0.0 109.896 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -56.32 -51.51 67.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.511 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -51.53 -52.86 43.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 110.822 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -53.48 44.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.032 0.833 . . . . 0.0 110.708 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -67.25 -12.54 60.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.2 m -90.29 -38.19 13.56 Favored 'General case' 0 C--O 1.228 -0.076 0 C-N-CA 124.129 0.972 . . . . 0.0 109.537 175.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -53.05 -44.83 67.72 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.848 0.859 . . . . 0.0 108.885 173.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -48.58 -56.86 7.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.245 0.618 . . . . 0.0 111.602 169.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -60.4 -49.38 77.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 O-C-N 121.991 -0.443 . . . . 0.0 110.483 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -55.95 -52.09 65.39 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.895 0.316 . . . . 0.0 110.188 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -50.99 -50.56 58.19 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.252 1.021 . . . . 0.0 110.786 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -59.98 -51.43 72.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.085 0.554 . . . . 0.0 110.253 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.23 -40.71 82.44 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.591 0.632 . . . . 0.0 111.532 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.5 mt -67.8 -16.3 64.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.696 0.799 . . . . 0.0 111.449 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.57 29.77 74.3 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -173.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-O 121.932 0.872 . . . . 0.0 109.147 -174.395 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.6 t -59.17 -46.55 92.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.64 -52.6 24.23 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.9 tp -60.08 -54.47 45.6 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 123.518 0.727 . . . . 0.0 110.808 -178.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.85 91.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.127 -176.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.416 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 73.9 mmm -56.83 -45.15 82.51 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.803 -0.561 . . . . 0.0 110.084 171.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.54 -55.72 5.17 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 124.916 1.246 . . . . 0.0 111.224 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 tptp -52.93 -48.85 67.01 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.652 0.781 . . . . 0.0 112.293 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.6 mt -90.01 -35.91 15.24 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -169.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -132.57 -59.26 0.91 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.259 1.423 . . . . 0.0 110.889 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.98 142.69 3.46 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 107.85 -2.1 . . . . 0.0 107.85 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -79.41 38.36 0.36 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.309 1.054 . . . . 0.0 113.314 -168.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.56 39.11 0.59 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.463 -0.773 . . . . 0.0 111.134 -174.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -144.19 31.14 1.25 Allowed 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 125.51 1.524 . . . . 0.0 108.996 -169.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.7 m -76.66 67.25 2.74 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.488 1.115 . . . . 0.0 108.163 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 75.15 -48.0 0.62 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.524 1.929 . . . . 0.0 113.124 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.5 p -49.23 -79.41 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.075 1.35 . . . . 0.0 112.266 -172.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.2 p -54.31 -44.97 72.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.404 1.082 . . . . 0.0 110.525 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.34 -53.62 37.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.716 0.806 . . . . 0.0 111.202 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.8 p -60.35 -48.88 79.85 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.775 -0.578 . . . . 0.0 110.15 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -58.27 -34.95 71.06 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.423 . . . . 0.0 111.984 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -69.43 -53.05 21.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 123.629 0.772 . . . . 0.0 110.307 178.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -55.6 -40.25 71.82 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.832 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.88 -10.79 59.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.359 1.064 . . . . 0.0 112.838 173.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.4 mt 58.74 45.66 15.36 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 127.121 2.168 . . . . 0.0 112.767 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.32 -30.45 30.45 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.844 1.258 . . . . 0.0 111.119 176.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -80.26 47.92 0.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.981 0.912 . . . . 0.0 113.094 -168.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 m -16.99 84.31 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 129.545 3.138 . . . . 0.0 116.82 -171.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.2 t80 66.05 -58.08 0.34 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.714 2.406 . . . . 0.0 114.725 172.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -44.25 -50.54 8.84 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.612 1.565 . . . . 0.0 112.379 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -47.07 21.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.0 mtt -45.6 -46.15 14.17 Favored 'General case' 0 C--O 1.225 -0.237 0 C-N-CA 125.22 1.408 . . . . 0.0 111.636 -174.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.9 t -64.82 -22.78 67.06 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -174.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -90.04 -46.87 8.21 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.369 1.08 . . . . 0.0 108.696 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.23 -38.74 77.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.971 1.708 . . . . 0.0 111.734 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -61.39 -63.04 4.77 Favored Pre-proline 0 N--CA 1.452 -0.327 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.16 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -58.1 -39.94 81.27 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 CA-C-N 120.869 1.346 . . . . 0.0 111.181 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.62 -57.23 11.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.18 0.592 . . . . 0.0 111.433 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.2 mt -69.43 -34.11 73.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -58.38 -49.53 76.91 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.018 0.827 . . . . 0.0 109.08 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -62.29 -43.75 98.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.416 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 67.0 t90 -53.16 -49.53 66.42 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 117.906 0.321 . . . . 0.0 110.978 172.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -50.62 72.5 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -174.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -54.31 -53.01 59.62 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.37 0.668 . . . . 0.0 110.84 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -56.42 -51.87 66.76 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.378 0.671 . . . . 0.0 110.969 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.167 0 C-N-CA 123.312 0.645 . . . . 0.0 110.207 178.823 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -40.15 -42.37 1.45 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.991 1.716 . . . . 0.0 112.467 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -74.59 -48.93 23.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.588 0.755 . . . . 0.0 110.244 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.11 -45.67 90.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.747 0.819 . . . . 0.0 111.088 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -57.43 -60.33 3.81 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.381 0.992 . . . . 0.0 111.04 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -56.91 -46.42 81.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.224 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -54.44 -48.6 71.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.329 0.513 . . . . 0.0 111.042 176.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.8 -51.41 67.19 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.614 1.166 . . . . 0.0 110.465 -176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -57.15 -45.28 83.73 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.502 0.668 . . . . 0.0 109.563 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.1 m -64.26 -32.18 73.67 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.909 -0.494 . . . . 0.0 110.494 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -63.28 -48.07 79.67 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.764 1.166 . . . . 0.0 109.345 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -52.3 -53.01 49.69 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 171.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -59.37 -44.35 92.73 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.649 -0.657 . . . . 0.0 111.81 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -59.12 -48.46 81.52 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.498 0.719 . . . . 0.0 110.312 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 64.9 ttp85 -52.04 -49.38 63.56 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.654 0.782 . . . . 0.0 110.252 175.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.03 -47.4 91.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 122.702 0.401 . . . . 0.0 110.143 178.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -59.26 -41.14 88.09 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.835 0.743 . . . . 0.0 111.604 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.53 -17.66 64.11 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.027 -0.42 . . . . 0.0 111.695 172.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.43 28.46 71.18 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -173.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 N--CA 1.454 -0.274 0 CA-C-N 117.47 0.635 . . . . 0.0 109.793 -176.745 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t0 . . . . . 0 C--O 1.226 -0.151 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.4 t -52.93 -52.84 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.07 175.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.37 -49.38 45.15 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.266 0.46 . . . . 0.0 112.262 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.4 tp -62.4 -53.64 51.92 Favored 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 121.701 0.762 . . . . 0.0 110.872 -177.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.97 92.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.745 0.818 . . . . 0.0 110.387 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -44.99 79.52 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.012 0.525 . . . . 0.0 109.747 171.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.08 -58.03 3.93 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.62 1.581 . . . . 0.0 111.352 169.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.8 -52.75 62.92 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.8 mt -75.34 -34.48 61.2 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -134.96 -59.5 0.79 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.087 0.955 . . . . 0.0 111.067 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 170.63 154.72 9.76 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 -171.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.12 68.24 4.11 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 123.604 0.761 . . . . 0.0 110.57 -169.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -112.29 172.69 6.76 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.59 1.956 . . . . 0.0 107.416 173.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 70.73 19.58 5.92 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -72.92 79.51 1.17 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 169.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 64.46 -67.16 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.412 2.285 . . . . 0.0 112.408 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 p -29.09 -75.45 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 127.829 2.452 . . . . 0.0 113.043 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -46.35 74.45 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.769 1.227 . . . . 0.0 111.251 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.6 mm -58.81 -49.92 81.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.484 1.114 . . . . 0.0 109.584 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.9 m -56.35 -54.1 49.47 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.83 -0.544 . . . . 0.0 110.226 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -71.05 -22.0 62.18 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -64.86 -56.26 14.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.07 -38.32 65.16 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 119.336 -0.364 . . . . 0.0 111.608 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.2 3.22 24.5 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mp 48.13 53.63 11.41 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.769 2.027 . . . . 0.0 114.779 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.55 -55.23 5.0 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.781 0.8 . . . . 0.0 111.326 170.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.98 -27.31 61.33 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -167.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m 67.94 164.88 0.23 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.597 1.159 . . . . 0.0 113.354 175.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -44.51 -45.48 9.29 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.178 1.391 . . . . 0.0 112.367 -169.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -36.05 -48.89 0.62 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 126.487 1.915 . . . . 0.0 113.14 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.58 -47.84 6.35 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 44.8 mtt -50.31 -41.43 51.07 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.922 -171.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.59 -21.33 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -176.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -89.22 -45.13 9.78 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.62 -39.74 92.36 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.36 0.664 . . . . 0.0 112.464 -174.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -57.89 -61.68 6.92 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.964 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.35 -39.86 73.2 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.455 1.437 . . . . 0.0 111.341 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 tt -51.5 -52.48 46.42 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.438 0.563 . . . . 0.0 111.155 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.3 -38.74 88.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.67 -0.644 . . . . 0.0 111.398 177.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.1 -48.09 79.46 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.299 0.499 . . . . 0.0 109.703 178.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -69.95 -36.25 75.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.217 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -52.82 -49.12 66.32 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 119.033 0.833 . . . . 0.0 109.644 169.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -52.42 65.73 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.14 -46.61 62.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.641 0.776 . . . . 0.0 110.733 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -64.57 -54.27 34.77 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.007 0.523 . . . . 0.0 110.466 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 C-N-CA 123.659 0.783 . . . . 0.0 110.488 -179.883 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp . . . . . 0 CA--C 1.53 0.182 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -51.39 -46.47 62.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.047 0.939 . . . . 0.0 111.405 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.8 -53.66 25.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.0 mt -54.59 -49.67 69.84 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.948 0.899 . . . . 0.0 111.876 -172.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.61 -60.95 2.98 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.07 0.85 . . . . 0.0 110.837 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.44 -55.87 11.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.659 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -49.42 -51.86 32.52 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.133 0.573 . . . . 0.0 110.748 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.26 -50.1 73.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.737 -0.602 . . . . 0.0 111.425 -174.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -60.2 -29.62 68.83 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.682 -0.636 . . . . 0.0 110.625 175.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.6 m -73.45 -42.57 61.78 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.476 -0.765 . . . . 0.0 109.44 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -52.26 -52.18 54.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -53.29 -54.93 29.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -55.72 -55.22 34.88 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.865 -0.522 . . . . 0.0 111.178 -178.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -60.49 -46.33 90.51 Favored 'General case' 0 C--O 1.224 -0.244 0 O-C-N 121.988 -0.445 . . . . 0.0 110.99 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -47.99 -51.93 21.86 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.675 1.19 . . . . 0.0 110.858 174.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.8 mt -60.36 -51.6 71.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 122.832 0.453 . . . . 0.0 109.876 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -56.34 -40.43 74.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.792 0.724 . . . . 0.0 112.105 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.47 -15.13 62.78 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.149 0.98 . . . . 0.0 111.565 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.78 19.83 79.74 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 123.754 0.692 . . . . 0.0 111.871 -177.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -52.7 -55.15 12.61 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 171.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.41 -49.63 14.95 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.654 0.661 . . . . 0.0 112.04 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.16 -54.37 46.65 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.118 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.24 82.69 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.705 0.802 . . . . 0.0 111.454 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.2 mmm -51.21 -46.13 62.12 Favored 'General case' 0 C--N 1.333 -0.112 0 C-N-CA 125.241 1.416 . . . . 0.0 109.54 169.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -58.1 5.12 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 125.317 1.436 . . . . 0.0 111.882 168.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.45 -50.03 75.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.526 0.33 . . . . 0.0 111.307 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -65.54 -49.41 69.01 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.273 0.488 . . . . 0.0 111.75 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -132.43 -55.42 0.96 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.193 0.997 . . . . 0.0 111.318 -169.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.98 142.26 3.37 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 108.531 -1.827 . . . . 0.0 108.531 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -81.14 74.8 8.13 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.142 0.971 . . . . 0.0 109.397 -174.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -98.02 26.09 5.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.148 167.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -141.99 42.71 1.69 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.27 -0.893 . . . . 0.0 110.073 -168.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.5 m -79.33 173.58 12.44 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -46.88 -44.45 19.63 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.646 0.778 . . . . 0.0 111.834 -171.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 p -48.84 -66.58 0.38 Allowed 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.206 1.402 . . . . 0.0 112.015 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -69.24 -40.7 77.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.714 0.806 . . . . 0.0 111.513 -173.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -61.39 -44.33 98.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.755 -0.591 . . . . 0.0 110.238 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 56.4 m -58.67 -45.06 90.23 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.014 -0.428 . . . . 0.0 110.621 170.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -40.24 66.67 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.541 0.736 . . . . 0.0 111.316 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -66.41 -60.36 2.83 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.311 1.045 . . . . 0.0 110.911 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -62.29 -26.37 68.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.02 8.13 34.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.858 0.863 . . . . 0.0 111.807 172.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp 43.64 36.38 1.23 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 126.752 2.021 . . . . 0.0 113.089 -178.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 -32.59 59.37 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.8 mt -57.76 -14.66 6.16 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.527 0.731 . . . . 0.0 112.183 168.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.2 m 72.58 -65.97 0.33 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.893 1.677 . . . . 0.0 113.728 168.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -169.26 -52.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.465 0.706 . . . . 0.0 110.443 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -37.62 -57.21 0.98 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.256 1.823 . . . . 0.0 113.295 -173.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -81.97 -43.64 17.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.676 0.751 . . . . 0.0 110.159 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 58.7 mtp -43.53 -42.51 5.01 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 125.023 1.329 . . . . 0.0 112.388 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.1 t -63.06 -21.55 66.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -90.7 -47.2 7.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.098 0.959 . . . . 0.0 109.487 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.64 -52.47 6.36 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.202 1.801 . . . . 0.0 110.371 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -61.47 -57.95 21.83 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 117.493 -1.241 . . . . 0.0 112.096 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -44.27 -49.27 8.96 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.43 2.087 . . . . 0.0 112.295 170.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 mp -60.53 -50.44 73.53 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 -172.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mt -64.64 -35.62 81.61 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.07 0.548 . . . . 0.0 111.985 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -62.26 -48.65 78.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -58.25 -46.89 85.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.405 173.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -52.07 -50.21 61.99 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.432 0.56 . . . . 0.0 111.047 175.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -42.26 89.8 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.844 0.458 . . . . 0.0 109.825 -173.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -53.46 -58.98 5.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.125 0.488 . . . . 0.0 109.879 170.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -58.91 -47.5 84.77 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.264 0.626 . . . . 0.0 110.404 -171.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.338 0 C-N-CA 124.794 1.238 . . . . 0.0 111.543 177.432 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -51.08 -46.99 61.95 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.597 1.159 . . . . 0.0 111.169 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.2 mp0 -69.33 -43.98 72.6 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.32 -51.47 45.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.79 1.636 . . . . 0.0 112.098 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -56.49 21.35 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.978 0.894 . . . . 0.0 109.637 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -52.31 -53.96 37.64 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.396 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -51.15 -53.11 37.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.65 1.18 . . . . 0.0 111.003 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.4 -48.09 81.79 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.908 0.483 . . . . 0.0 110.463 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.34 -37.29 86.69 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.145 0.498 . . . . 0.0 111.521 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.4 m -65.71 -36.68 84.32 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 121.81 -0.557 . . . . 0.0 109.884 176.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -56.73 -45.1 82.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.393 0.542 . . . . 0.0 111.142 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -59.47 -49.14 78.94 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.036 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -59.28 -46.94 87.18 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.881 -0.512 . . . . 0.0 110.519 -177.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -63.41 -45.01 92.97 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.492 0.717 . . . . 0.0 110.319 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -54.24 -48.24 71.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.506 0.722 . . . . 0.0 110.246 174.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.3 mt -61.9 -40.69 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.051 0.54 . . . . 0.0 109.82 177.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -61.04 -43.17 99.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.446 0.567 . . . . 0.0 111.26 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.27 -37.89 84.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.456 0.571 . . . . 0.0 110.244 170.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.37 35.72 9.32 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 124.637 1.113 . . . . 0.0 110.323 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 . . . . . 0 CA--C 1.523 -0.074 0 CA-C-O 121.477 0.656 . . . . 0.0 109.876 179.259 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 70.6 t -55.53 -43.16 71.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 174.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.66 -51.0 51.47 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.71 -52.9 63.5 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.61 0.764 . . . . 0.0 110.292 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.13 74.06 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.711 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -44.85 92.25 Favored 'General case' 0 C--O 1.224 -0.255 0 O-C-N 121.842 -0.536 . . . . 0.0 110.196 175.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.5 -54.29 5.68 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 124.827 1.203 . . . . 0.0 111.374 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -62.56 -50.99 69.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.638 0.375 . . . . 0.0 111.577 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.28 -25.49 36.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -169.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -142.81 -60.74 0.43 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.572 1.149 . . . . 0.0 110.782 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 154.05 139.34 2.82 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 107.021 -2.431 . . . . 0.0 107.021 -169.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -82.24 69.42 8.97 Favored 'General case' 0 C--N 1.337 0.044 0 CA-C-N 118.481 1.141 . . . . 0.0 110.376 -170.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -92.44 35.18 1.02 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.01 0.524 . . . . 0.0 110.441 170.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -134.43 -52.8 0.83 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 121.506 -0.746 . . . . 0.0 111.771 -167.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p 30.36 -98.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.267 2.227 . . . . 0.0 112.567 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tm0? -125.23 -59.96 1.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.807 1.643 . . . . 0.0 108.831 172.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.45 -58.31 7.96 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 123.937 0.895 . . . . 0.0 112.755 -167.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -41.64 99.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.729 0.695 . . . . 0.0 111.342 -177.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -57.59 -47.43 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.964 0.802 . . . . 0.0 110.871 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -63.05 -45.97 89.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.961 -0.462 . . . . 0.0 110.17 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -59.2 -40.43 85.75 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.629 0.772 . . . . 0.0 111.485 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -60.52 -55.46 33.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.153 0.581 . . . . 0.0 109.945 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -59.43 -39.22 82.83 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.645 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.09 -5.85 38.27 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 173.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.9 mt 58.52 42.39 21.0 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.707 2.003 . . . . 0.0 111.825 176.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -79.79 -31.51 40.81 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.846 0.858 . . . . 0.0 111.805 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.55 31.05 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.949 1.462 . . . . 0.0 114.949 -168.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 92.3 p 55.06 -80.54 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.515 2.326 . . . . 0.0 113.595 -178.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -174.74 -38.89 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.612 2.365 . . . . 0.0 109.335 -176.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -44.89 -52.18 8.88 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.616 1.166 . . . . 0.0 112.738 -174.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -76.73 -47.09 22.89 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.7 mtt -41.49 -46.9 3.61 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 125.184 1.394 . . . . 0.0 112.334 -177.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.5 t -61.42 -27.52 68.61 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -82.64 -51.19 7.97 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -45.1 -46.32 11.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.884 2.074 . . . . 0.0 111.799 -176.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -64.26 -64.02 3.23 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.99 -174.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.56 -37.46 96.99 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.476 1.451 . . . . 0.0 111.081 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.98 -56.93 12.31 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.231 0.612 . . . . 0.0 111.027 175.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.9 mt -67.88 -35.56 78.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.103 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.22 -49.75 75.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.834 0.743 . . . . 0.0 109.96 176.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -66.99 -42.01 85.78 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -52.21 -47.55 65.55 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 122.011 -0.43 . . . . 0.0 110.459 170.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -53.42 57.43 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -45.62 -53.56 9.01 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.89 0.876 . . . . 0.0 110.427 174.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.84 -45.71 91.33 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.79 -177.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.279 0 C-N-CA 123.736 0.814 . . . . 0.0 111.134 -176.75 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 N--CA 1.451 -0.389 0 CA-C-O 121.012 0.434 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp -40.14 -48.34 2.5 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.641 1.576 . . . . 0.0 111.35 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -53.97 -36.47 62.9 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.388 0.675 . . . . 0.0 112.558 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -79.87 -49.12 12.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.553 0.615 . . . . 0.0 109.443 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -51.78 -48.85 63.62 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.843 -0.599 . . . . 0.0 111.786 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -55.95 -62.71 1.52 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 118.801 0.728 . . . . 0.0 111.43 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -59.06 -43.62 91.73 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.612 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -56.0 -52.36 64.5 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 110.196 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -52.3 66.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.142 0.977 . . . . 0.0 110.327 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.66 -48.86 63.25 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.81 0.844 . . . . 0.0 109.884 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.6 m -62.29 -45.82 91.54 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.057 0.543 . . . . 0.0 110.64 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -54.91 -45.95 74.81 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.105 0.562 . . . . 0.0 109.568 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.9 -46.14 85.39 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.03 -0.419 . . . . 0.0 111.258 174.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -59.16 -46.79 87.46 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.248 0.931 . . . . 0.0 110.567 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -58.89 -46.45 87.82 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 122.184 -0.322 . . . . 0.0 110.518 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -55.17 -47.12 75.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.544 0.738 . . . . 0.0 110.948 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 81.9 mt -59.54 -46.96 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 123.109 0.563 . . . . 0.0 109.773 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -57.77 -42.02 83.21 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.468 0.576 . . . . 0.0 111.224 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.47 -15.66 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.24 33.04 72.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 -173.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -91.89 79.45 5.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 122.634 1.207 . . . . 0.0 109.091 -174.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 t -105.69 -178.03 3.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.666 1.986 . . . . 0.0 108.771 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 59.51 -71.87 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 127.585 2.354 . . . . 0.0 110.117 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -169.07 39.21 0.21 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 169.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -59.48 -49.8 76.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.946 1.373 . . . . 0.0 110.549 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.1 t -50.81 -50.44 23.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.267 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.83 -44.74 55.62 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.452 0.549 . . . . 0.0 112.389 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.41 -52.1 59.86 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 123.819 0.847 . . . . 0.0 110.396 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.33 -57.42 12.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.437 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 10.5 ttm -50.32 -42.49 52.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.546 1.138 . . . . 0.0 111.293 169.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.55 -54.28 6.61 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 124.721 1.153 . . . . 0.0 111.875 170.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -67.19 -49.08 65.92 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.61 0.364 . . . . 0.0 111.459 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.6 mt -71.66 -53.44 13.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.479 0.712 . . . . 0.0 112.49 -169.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -116.45 -58.18 2.11 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.836 1.654 . . . . 0.0 111.142 -169.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.35 152.38 7.61 Favored Glycine 0 CA--C 1.532 1.122 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 -171.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.63 60.91 1.73 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.283 1.433 . . . . 0.0 113.216 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -110.36 174.32 5.92 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.768 1.227 . . . . 0.0 108.029 172.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 66.7 39.88 3.46 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.379 1.072 . . . . 0.0 112.302 176.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -74.85 57.65 0.79 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.565 1.546 . . . . 0.0 109.855 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 72.53 -53.03 0.7 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.361 1.465 . . . . 0.0 111.25 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -41.66 -70.8 0.1 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 127.761 2.424 . . . . 0.0 111.715 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.96 -32.83 74.24 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.259 0.624 . . . . 0.0 111.461 -171.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 18.2 mm -60.52 -53.56 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 171.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -53.94 -48.37 70.31 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.999 -0.438 . . . . 0.0 110.535 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -56.71 -42.83 79.87 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.498 175.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -57.85 -55.52 33.8 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.876 0.47 . . . . 0.0 110.311 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -57.13 -38.03 72.87 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.551 176.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.28 -1.36 26.21 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.7 mp 51.26 30.58 5.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.231 1.813 . . . . 0.0 112.988 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -83.9 35.22 0.52 Allowed 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.897 -1.127 . . . . 0.0 111.004 -174.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.7 mt -139.86 19.66 2.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.666 1.586 . . . . 0.0 110.513 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.0 m 28.64 60.84 0.13 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.336 2.655 . . . . 0.0 116.029 169.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.2 t80 68.89 -58.59 0.49 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.51 1.924 . . . . 0.0 114.417 171.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -41.3 -56.0 2.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 113.262 -170.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -76.69 -49.69 15.5 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.565 0.698 . . . . 0.0 109.365 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 89.0 mtp -45.12 -44.8 10.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.602 1.561 . . . . 0.0 112.847 -173.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.9 t -59.77 -35.67 75.11 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.9 0.48 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.5 mttp -79.38 -35.97 39.92 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.644 0.778 . . . . 0.0 110.066 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -65.32 -45.3 84.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.074 0.95 . . . . 0.0 112.132 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -44.67 -62.25 1.7 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.212 1.005 . . . . 0.0 113.434 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -60.28 -34.53 93.66 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 121.974 1.783 . . . . 0.0 112.33 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.1 -48.28 80.87 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 mt -64.24 -38.76 92.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 118.108 0.413 . . . . 0.0 111.507 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.09 -51.62 69.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.91 0.777 . . . . 0.0 109.881 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -60.93 -39.06 87.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.545 0.338 . . . . 0.0 110.162 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -56.98 -44.8 83.06 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 121.761 -0.587 . . . . 0.0 109.916 173.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -47.32 86.36 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.921 0.888 . . . . 0.0 109.426 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.96 -46.65 78.53 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.974 0.509 . . . . 0.0 110.915 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -67.37 -51.2 54.99 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.568 1.147 . . . . 0.0 112.204 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 41.09 48.78 3.0 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 128.29 2.636 . . . . 0.0 113.959 -174.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 169.748 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 120.52 0.2 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.9 mp -46.11 -40.66 11.26 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.154 1.382 . . . . 0.0 112.257 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -47.74 -40.6 20.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.66 0.784 . . . . 0.0 111.98 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.35 -43.84 93.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.893 -0.505 . . . . 0.0 109.806 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.98 -49.1 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.426 1.09 . . . . 0.0 110.328 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -54.6 44.55 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.145 0.884 . . . . 0.0 110.882 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -55.14 -51.05 67.7 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -54.88 -49.7 70.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.882 0.473 . . . . 0.0 110.974 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.9 -51.35 67.91 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 110.651 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -62.59 -42.7 99.72 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.936 -0.477 . . . . 0.0 110.725 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.8 m -61.02 -44.94 96.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.174 0.589 . . . . 0.0 110.258 176.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -55.71 -48.33 75.34 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.811 1.244 . . . . 0.0 109.042 176.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -55.31 -45.13 76.33 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.183 173.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -59.18 -49.43 77.88 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.226 0.921 . . . . 0.0 110.645 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -55.29 -47.01 76.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.012 -0.43 . . . . 0.0 110.694 176.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.3 ttp85 -57.8 -45.05 86.65 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 110.949 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.9 mt -61.99 -46.75 95.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 C-N-CA 123.385 0.674 . . . . 0.0 109.822 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.28 -41.01 78.93 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.801 0.728 . . . . 0.0 110.848 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.99 -13.43 62.45 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 173.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.54 29.37 72.91 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 123.891 0.758 . . . . 0.0 111.286 -177.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -97.17 143.74 27.68 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 117.448 0.624 . . . . 0.0 109.821 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 t -165.71 -178.48 4.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 50.38 -107.4 0.27 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.746 1.618 . . . . 0.0 111.094 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.61 10.67 28.06 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 118.625 -1.097 . . . . 0.0 112.514 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.09 -61.94 2.24 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 119.613 1.707 . . . . 0.0 109.157 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.67 -40.4 79.23 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-O 118.622 -0.704 . . . . 0.0 109.339 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.15 -57.44 6.3 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 174.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.4 tp -60.71 -43.27 98.04 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.561 0.744 . . . . 0.0 109.725 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.51 78.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.381 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 31.2 mmm -65.99 -45.98 79.65 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -38.38 -51.05 2.33 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 126.813 2.149 . . . . 0.0 111.919 172.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -57.43 -40.31 78.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.0 mt -99.5 -53.87 3.09 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.671 0.388 . . . . 0.0 111.547 -169.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -112.58 -48.68 2.99 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.709 1.604 . . . . 0.0 110.908 -169.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.02 155.59 6.48 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 108.681 -1.768 . . . . 0.0 108.681 -169.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -76.96 68.27 3.1 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.119 0.96 . . . . 0.0 110.273 -173.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -85.2 -58.45 2.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.346 0.658 . . . . 0.0 109.714 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -93.27 89.84 6.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.999 -0.438 . . . . 0.0 111.868 -168.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 m -100.34 -179.24 4.06 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 169.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -51.25 -36.28 41.17 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.7 p -53.04 -73.59 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.795 0.838 . . . . 0.0 109.82 172.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -43.33 65.74 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.547 1.139 . . . . 0.0 111.807 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.77 -48.04 81.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 O-C-N 121.504 -0.747 . . . . 0.0 111.47 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.7 p -56.01 -45.14 79.17 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.395 -1.441 . . . . 0.0 110.201 174.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -37.07 75.28 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.961 0.504 . . . . 0.0 111.915 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -58.88 -55.45 34.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.139 0.976 . . . . 0.0 110.012 173.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.15 -27.94 69.72 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.12 -4.34 56.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.5 0.72 . . . . 0.0 112.436 171.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp 53.96 31.44 13.47 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.071 2.148 . . . . 0.0 113.996 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -92.25 27.64 2.15 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.538 -0.726 . . . . 0.0 111.494 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 mt -128.85 31.06 5.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.901 1.68 . . . . 0.0 107.887 170.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 m -33.73 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 129.913 3.285 . . . . 0.0 114.704 -168.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 23.0 t80 68.65 -58.24 0.48 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.745 2.418 . . . . 0.0 113.323 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -43.14 -51.71 5.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.902 1.681 . . . . 0.0 113.074 -172.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -81.55 -48.32 11.95 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.9 mtt -43.84 -40.41 4.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 126.195 1.798 . . . . 0.0 112.761 -173.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.7 t -66.94 -23.37 65.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.085 -1.046 . . . . 0.0 113.063 -176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.62 -55.22 3.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.905 0.86 . . . . 0.0 108.701 169.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -48.02 -44.23 30.78 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.109 2.164 . . . . 0.0 112.294 -177.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -63.64 -62.95 4.53 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.436 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.55 -37.01 96.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.205 1.27 . . . . 0.0 111.881 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.0 -49.91 72.83 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.0 mt -61.88 -40.34 95.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.312 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -57.0 -53.7 55.12 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.78 0.718 . . . . 0.0 109.795 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -58.93 -46.02 88.98 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.679 0.392 . . . . 0.0 110.438 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -54.56 -45.09 73.42 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.479 0.312 . . . . 0.0 110.639 176.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.83 -44.44 85.55 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.01 -40.05 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.768 0.427 . . . . 0.0 110.503 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.69 -59.47 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.17 0.588 . . . . 0.0 111.488 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.82 69.8 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.266 1.026 . . . . 0.0 112.563 -169.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 . . . . . 0 N--CA 1.456 -0.162 0 C-N-CA 125.456 1.502 . . . . 0.0 112.251 -173.216 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.4 t70 . . . . . 0 N--CA 1.455 -0.223 0 CA-C-O 120.605 0.241 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp -50.66 -41.89 55.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.659 0.784 . . . . 0.0 111.394 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -53.86 -47.51 70.95 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.587 0.355 . . . . 0.0 110.967 173.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -65.55 -43.35 90.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.501 0.721 . . . . 0.0 110.053 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.14 -47.09 81.99 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.737 0.415 . . . . 0.0 110.404 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -56.63 18.96 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.546 0.738 . . . . 0.0 110.298 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -52.27 -54.18 34.51 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.738 0.815 . . . . 0.0 109.077 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -54.95 -49.92 70.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.634 0.774 . . . . 0.0 111.055 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.51 -52.97 60.28 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.159 0.89 . . . . 0.0 110.814 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -60.32 -38.69 84.49 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.49 -0.757 . . . . 0.0 111.132 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 85.7 m -65.2 -44.63 87.73 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.552 -0.717 . . . . 0.0 109.829 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -53.07 -54.06 41.05 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.807 1.243 . . . . 0.0 108.865 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.43 -52.33 62.12 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 177.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -56.65 -54.29 47.74 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.934 -0.479 . . . . 0.0 111.367 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -57.25 -48.32 79.16 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 122.094 -0.379 . . . . 0.0 110.528 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.7 ttp85 -50.79 -50.42 56.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.766 0.826 . . . . 0.0 110.569 176.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.78 -49.26 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 C-N-CA 122.979 0.512 . . . . 0.0 110.023 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -55.48 -42.41 74.32 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.82 0.737 . . . . 0.0 111.239 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.5 mt -68.54 -17.87 64.24 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.377 0.671 . . . . 0.0 112.075 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.93 25.7 75.16 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -87.44 92.41 9.07 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 122.096 0.95 . . . . 0.0 108.46 -176.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -51.82 159.52 0.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.17 1.388 . . . . 0.0 111.251 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -38.62 45.73 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.778 -0.576 . . . . 0.0 110.153 169.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.05 -57.42 16.64 Favored Glycine 0 CA--C 1.53 1.005 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 171.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -52.63 -53.02 52.6 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 117.454 0.627 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.87 -56.31 13.31 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.56 -48.77 34.74 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 123.811 0.72 . . . . 0.0 111.746 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.62 -54.86 29.22 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.451 0.643 . . . . 0.0 110.933 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.63 -48.97 77.98 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.964 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -40.3 81.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.471 0.708 . . . . 0.0 110.413 174.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -46.88 -55.89 8.0 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 125.004 1.287 . . . . 0.0 111.112 169.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -61.42 -48.22 82.17 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -80.99 -28.93 35.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -145.16 -63.53 0.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 111.049 -172.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.87 140.52 3.34 Favored Glycine 0 CA--C 1.529 0.945 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 -169.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.28 61.06 5.31 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 122.112 -0.64 . . . . 0.0 111.351 -168.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -81.64 -151.86 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 64.4 31.9 12.35 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.422 -0.799 . . . . 0.0 112.085 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -76.77 54.2 0.97 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.078 1.751 . . . . 0.0 110.235 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 66.39 -67.36 0.15 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.983 1.713 . . . . 0.0 109.99 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.2 p -28.45 -73.4 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 128.16 2.584 . . . . 0.0 111.838 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.8 m -53.49 -37.85 63.12 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.373 1.869 . . . . 0.0 112.714 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -75.02 -48.96 30.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 121.631 -0.668 . . . . 0.0 109.829 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.9 m -53.95 -48.77 69.94 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.587 -0.696 . . . . 0.0 110.652 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -58.52 -40.76 83.79 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.522 1.129 . . . . 0.0 110.936 176.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -57.56 -56.62 19.57 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.311 0.505 . . . . 0.0 110.31 175.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -65.55 -25.28 67.36 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.71 -5.13 44.17 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.058 0.845 . . . . 0.0 112.083 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 50.03 42.39 24.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.508 1.923 . . . . 0.0 111.552 -171.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -79.86 -34.68 39.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.78 0.832 . . . . 0.0 112.005 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.38 52.11 1.55 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.899 0.88 . . . . 0.0 111.931 -169.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 m -24.17 85.43 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.515 3.126 . . . . 0.0 116.757 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 t80 68.43 -57.76 0.48 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.759 2.424 . . . . 0.0 114.224 170.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -43.32 -50.98 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.198 1.799 . . . . 0.0 112.358 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -46.54 22.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 62.6 mtt -46.81 -44.91 19.68 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.913 1.285 . . . . 0.0 112.136 -172.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 22.2 t -64.39 -22.18 66.87 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -175.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.3 -51.91 5.32 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.063 0.935 . . . . 0.0 108.607 171.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.3 tp -47.1 -45.49 22.17 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 127.669 2.388 . . . . 0.0 112.041 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -63.66 -64.14 3.22 Favored Pre-proline 0 N--CA 1.453 -0.286 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.371 -176.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -56.28 -39.46 91.13 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 CA-C-N 120.87 1.346 . . . . 0.0 111.202 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tt -53.66 -57.7 9.85 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 123.005 0.522 . . . . 0.0 111.563 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 83.2 mt -70.75 -31.18 67.91 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.151 0.58 . . . . 0.0 110.958 -178.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.84 -46.17 89.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.73 -41.91 91.65 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.131 -0.356 . . . . 0.0 110.116 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -52.53 -46.73 66.85 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.156 0.434 . . . . 0.0 110.325 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.45 -46.78 86.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.11 -52.17 53.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.806 0.275 . . . . 0.0 110.638 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.79 -54.46 46.87 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.782 0.433 . . . . 0.0 111.709 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.52 -36.68 76.65 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.64 1.176 . . . . 0.0 111.652 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 CA--C 1.532 0.274 0 C-N-CA 126.908 2.083 . . . . 0.0 107.309 178.885 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 p30 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp -57.42 -43.26 83.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.017 0.527 . . . . 0.0 111.265 -174.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.31 -54.23 47.89 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.764 0.426 . . . . 0.0 109.966 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.97 -44.32 91.49 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.347 0.659 . . . . 0.0 110.95 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -57.93 -48.07 81.01 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.713 0.405 . . . . 0.0 110.712 176.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -55.84 29.79 Favored 'General case' 0 C--N 1.337 0.05 0 C-N-CA 123.134 0.574 . . . . 0.0 109.658 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -54.23 -51.91 63.0 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.67 0.388 . . . . 0.0 110.262 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -54.43 -53.76 49.89 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.452 0.701 . . . . 0.0 110.688 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.91 92.03 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.756 0.422 . . . . 0.0 111.114 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.5 ttpm? -56.36 -45.43 80.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.766 0.826 . . . . 0.0 109.798 174.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.3 m -63.57 -42.03 98.34 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.064 -0.397 . . . . 0.0 110.808 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -55.46 -51.1 68.06 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.35 -51.91 66.54 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.958 0.503 . . . . 0.0 110.85 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -45.97 88.73 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.745 -0.597 . . . . 0.0 110.421 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -65.98 -45.84 80.22 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.797 0.439 . . . . 0.0 109.848 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.4 ttp85 -50.58 -51.81 44.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 109.988 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 88.3 mt -59.42 -48.54 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.5 -42.46 78.38 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.4 0.546 . . . . 0.0 111.372 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.59 -16.23 63.79 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.7 0.8 . . . . 0.0 111.722 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.7 28.44 73.76 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -86.17 102.86 14.28 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -176.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -64.67 173.2 2.3 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.541 1.137 . . . . 0.0 111.718 -172.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mp0 -48.98 -48.91 42.95 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.855 1.262 . . . . 0.0 107.785 168.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.93 -55.7 26.61 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 124.595 1.093 . . . . 0.0 111.258 174.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.47 -58.25 7.8 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.036 0.918 . . . . 0.0 110.825 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.09 -48.38 89.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -176.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.92 -52.74 24.99 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 118.744 0.702 . . . . 0.0 111.659 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.11 -56.36 21.72 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.843 0.857 . . . . 0.0 110.46 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.73 -45.77 91.16 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.018 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mmm -55.51 -45.99 77.02 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 121.814 -0.554 . . . . 0.0 110.053 170.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.44 -57.08 4.55 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.754 1.168 . . . . 0.0 111.794 169.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -59.25 -50.5 73.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.787 0.293 . . . . 0.0 111.344 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.8 mt -78.14 -29.5 48.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -171.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.541 ' HH ' ' HZ1' ' A' ' 69' ' ' LYS . 84.3 m-85 -146.24 -61.4 0.31 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.127 0.971 . . . . 0.0 111.456 -172.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 164.96 138.7 2.47 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 107.616 -2.193 . . . . 0.0 107.616 -169.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -78.73 38.87 0.33 Allowed 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.665 -0.903 . . . . 0.0 113.268 -168.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -81.38 41.75 0.63 Allowed 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.289 -0.882 . . . . 0.0 111.362 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -147.45 33.81 0.87 Allowed 'General case' 0 CA--C 1.524 -0.033 0 C-N-CA 124.094 0.958 . . . . 0.0 109.971 -169.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.6 m -73.07 64.58 0.73 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.814 1.246 . . . . 0.0 110.266 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 68.96 -60.56 0.45 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.413 1.885 . . . . 0.0 111.972 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 m -45.12 -66.3 0.42 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.9 1.28 . . . . 0.0 111.797 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.49 -41.07 69.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.267 1.027 . . . . 0.0 111.729 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.7 mm -64.73 -43.79 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.483 0.713 . . . . 0.0 109.991 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.436 ' HG ' HH21 ' A' ' 49' ' ' ARG . 85.6 p -65.42 -43.34 90.84 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.751 -0.593 . . . . 0.0 110.731 176.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.436 HH21 ' HG ' ' A' ' 48' ' ' SER . 4.8 mmp_? -58.88 -45.94 89.02 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 118.51 0.596 . . . . 0.0 109.707 177.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -55.73 -57.95 9.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.254 1.022 . . . . 0.0 110.327 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -62.19 -34.99 77.5 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 -3.86 30.06 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 172.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 59.1 28.78 18.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.953 1.701 . . . . 0.0 111.926 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.35 -34.69 58.94 Favored 'General case' 0 C--N 1.333 -0.125 0 O-C-N 121.133 -0.98 . . . . 0.0 109.002 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 68.5 mt -62.98 -5.05 2.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 112.388 170.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.0 m 69.91 -65.16 0.32 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.722 1.609 . . . . 0.0 115.18 166.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -166.18 -53.28 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.826 0.739 . . . . 0.0 111.489 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -46.37 -51.54 14.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.924 0.889 . . . . 0.0 113.202 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -77.73 -52.15 9.4 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.6 mmm -38.04 -51.22 1.38 Allowed 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 126.338 1.855 . . . . 0.0 111.267 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 31.3 t -65.8 -29.28 69.74 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -84.63 -40.39 17.52 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.975 0.893 . . . . 0.0 108.978 175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -67.74 -35.02 77.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.844 1.257 . . . . 0.0 113.584 -176.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -50.33 -67.39 0.47 Allowed Pre-proline 0 CA--C 1.536 0.406 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.885 173.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -57.75 -37.03 98.01 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.907 1.738 . . . . 0.0 111.394 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tt -53.6 -55.38 26.27 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.611 0.764 . . . . 0.0 111.117 173.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.3 mt -66.71 -31.9 72.86 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.781 -0.574 . . . . 0.0 112.02 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.09 -47.71 78.98 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.573 -0.704 . . . . 0.0 109.254 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.541 ' HZ1' ' HH ' ' A' ' 38' ' ' TYR . 8.4 mtmp? -64.2 -39.98 95.12 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 119.245 -0.407 . . . . 0.0 110.608 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 68.8 t90 -52.42 -49.1 65.21 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.459 0.572 . . . . 0.0 110.181 169.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.72 -47.48 85.07 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -175.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.81 -53.27 50.94 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.823 0.449 . . . . 0.0 110.69 175.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.82 -50.09 75.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.674 0.39 . . . . 0.0 111.41 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.58 -34.67 78.42 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.903 1.281 . . . . 0.0 111.449 -175.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 N--CA 1.453 -0.28 0 C-N-CA 125.021 1.328 . . . . 0.0 110.687 -179.273 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 . . . . . 0 CA--C 1.534 0.342 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mp -41.0 -53.41 2.98 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.882 1.673 . . . . 0.0 112.958 -169.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -52.48 -40.6 62.51 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.935 0.894 . . . . 0.0 111.902 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -70.58 -54.37 12.32 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.5 mt -52.25 -52.96 49.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 112.102 -171.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.18 -59.73 4.28 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.57 0.7 . . . . 0.0 111.588 -174.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -53.24 -60.22 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.411 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -50.6 -50.19 54.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.187 0.995 . . . . 0.0 111.35 -172.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.32 -53.24 60.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.556 0.693 . . . . 0.0 110.476 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -65.49 -22.74 66.76 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.66 -0.65 . . . . 0.0 111.542 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 57.6 m -75.96 -40.38 54.08 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.366 -0.834 . . . . 0.0 109.455 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.62 -48.44 72.21 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 170.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.2 tttp -54.38 -55.65 26.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.699 0.285 . . . . 0.0 111.671 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -57.41 -52.07 66.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.746 -0.596 . . . . 0.0 111.218 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpt85 -60.26 -44.67 95.08 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.161 0.584 . . . . 0.0 110.421 -178.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 58.9 ttp85 -52.72 -49.41 65.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.073 0.949 . . . . 0.0 110.482 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 75.1 mt -59.66 -46.87 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-O 119.128 -0.463 . . . . 0.0 110.059 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -57.02 -42.12 79.82 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.085 0.857 . . . . 0.0 111.299 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.24 -18.42 65.34 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.741 0.416 . . . . 0.0 112.086 174.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.09 24.43 74.6 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 -172.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -85.67 92.97 8.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 122.609 1.195 . . . . 0.0 108.492 -175.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.8 t -62.12 167.71 3.79 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.987 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.81 -53.9 4.38 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.73 1.212 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -51.34 -47.52 50.35 Favored Glycine 0 CA--C 1.529 0.965 0 C-N-CA 124.267 0.937 . . . . 0.0 112.818 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -63.45 -52.12 62.79 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.423 1.111 . . . . 0.0 109.507 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.4 t -57.74 -52.43 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.22 -48.51 47.0 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.39 -56.92 15.19 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 117.494 0.647 . . . . 0.0 110.167 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.03 -46.22 90.22 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.894 -176.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -47.02 60.99 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.957 1.303 . . . . 0.0 109.41 170.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -48.8 -59.15 6.95 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.943 1.259 . . . . 0.0 112.307 169.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.25 -47.81 77.79 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 117.06 0.43 . . . . 0.0 111.409 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.1 mt -73.5 -50.35 21.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -126.3 -59.05 1.33 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.938 0.895 . . . . 0.0 112.0 -168.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 158.55 135.1 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -169.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -82.39 73.6 9.41 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.699 -0.883 . . . . 0.0 110.331 -170.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.79 27.67 2.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.311 167.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -148.13 47.17 1.07 Allowed 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.852 -0.53 . . . . 0.0 110.403 -167.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.2 p -60.04 -59.88 4.71 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.921 0.888 . . . . 0.0 109.154 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -159.29 -54.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.062 1.345 . . . . 0.0 109.029 -177.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.0 p -48.69 -69.74 0.11 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.414 1.485 . . . . 0.0 111.023 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.2 m -49.12 -49.14 43.48 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.22 1.408 . . . . 0.0 111.363 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.6 mm -60.21 -47.8 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.993 0.917 . . . . 0.0 110.533 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m -62.59 -48.19 80.54 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.205 -0.309 . . . . 0.0 110.475 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -36.88 82.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.284 0.634 . . . . 0.0 110.925 178.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -63.6 -52.28 61.61 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 118.671 0.669 . . . . 0.0 110.639 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -58.22 -33.25 69.11 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.661 0.784 . . . . 0.0 112.082 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.47 8.89 22.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.066 0.946 . . . . 0.0 112.373 172.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.5 mp 36.83 44.88 0.38 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.64 2.376 . . . . 0.0 113.459 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -85.52 -53.05 5.43 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.713 1.205 . . . . 0.0 108.955 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.87 101.61 0.22 Allowed 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.11 -179.89 1.36 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.053 1.741 . . . . 0.0 114.357 -167.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -40.53 -46.79 2.56 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.825 1.65 . . . . 0.0 113.906 -169.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -41.46 -46.16 3.37 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.249 1.42 . . . . 0.0 112.555 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -79.02 -58.43 3.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.69 0.796 . . . . 0.0 108.886 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 41.4 mtt -44.95 -49.89 10.86 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.785 1.234 . . . . 0.0 112.117 -170.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.4 t -66.19 -36.95 84.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.629 -169.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -74.01 -43.18 58.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.498 0.666 . . . . 0.0 109.677 172.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.3 tp -64.64 -46.5 82.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.864 0.866 . . . . 0.0 112.003 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -52.33 -56.55 21.27 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.961 -173.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.06 -36.51 89.07 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 CA-C-N 121.247 1.481 . . . . 0.0 111.824 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -61.21 -52.08 66.29 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -63.14 -38.9 93.0 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.349 0.66 . . . . 0.0 111.341 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -58.74 -51.94 67.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -64.08 -40.05 95.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.282 -0.261 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 54.4 t90 -53.78 -46.72 71.11 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 172.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.64 -46.23 80.03 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.89 -51.81 59.82 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.016 0.526 . . . . 0.0 110.906 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -58.73 -50.95 72.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.359 0.664 . . . . 0.0 111.099 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.19 96.41 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.022 0.929 . . . . 0.0 111.382 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 N--CA 1.453 -0.286 0 C-N-CA 125.922 1.689 . . . . 0.0 111.24 -176.036 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.122 0.487 . . . . 0.0 110.39 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -66.38 -8.1 23.43 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -169.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -54.49 -36.98 64.74 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.053 -1.029 . . . . 0.0 109.49 168.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -61.96 -50.26 72.83 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.283 0.633 . . . . 0.0 109.741 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -55.69 -43.39 76.38 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 124.358 1.063 . . . . 0.0 109.688 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -55.48 22.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.592 0.757 . . . . 0.0 109.397 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -54.08 -56.23 20.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -50.63 -54.11 25.44 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.184 0.594 . . . . 0.0 110.992 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.74 -50.38 73.7 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.785 -0.572 . . . . 0.0 110.475 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -28.02 68.76 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.73 -0.606 . . . . 0.0 111.384 176.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 90.1 m -70.92 -45.47 64.19 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -55.04 -44.31 74.56 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.728 0.411 . . . . 0.0 110.08 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -55.97 -54.1 48.88 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.99 -0.444 . . . . 0.0 110.741 174.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -55.1 -46.33 75.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.995 -0.441 . . . . 0.0 111.002 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -53.44 -50.68 64.75 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.186 0.448 . . . . 0.0 110.298 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -54.34 -48.01 71.88 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.559 0.618 . . . . 0.0 111.658 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.39 -54.86 20.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.399 0.545 . . . . 0.0 109.724 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -55.52 -43.85 76.09 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.082 0.401 . . . . 0.0 111.148 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.05 -14.25 60.21 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.355 0.662 . . . . 0.0 112.279 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.16 34.88 87.53 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -173.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -90.13 92.17 8.85 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 122.146 0.974 . . . . 0.0 110.182 -176.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.6 t -124.83 -171.59 2.39 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.144 2.178 . . . . 0.0 107.96 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 57.95 -72.21 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.553 2.741 . . . . 0.0 111.284 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -173.43 39.37 0.14 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 170.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -57.5 -55.77 30.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.522 1.161 . . . . 0.0 109.654 177.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.7 t -50.39 -49.61 23.44 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.992 171.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.9 -46.33 32.11 Favored Glycine 0 CA--C 1.527 0.809 0 C-N-CA 123.816 0.722 . . . . 0.0 113.75 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.3 -50.89 68.3 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.28 1.04 . . . . 0.0 110.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.93 -52.42 65.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.158 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -37.96 58.29 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.886 1.274 . . . . 0.0 109.772 169.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -49.72 -59.83 6.98 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 125.612 1.577 . . . . 0.0 111.16 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -62.84 -39.91 95.83 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.517 0.198 . . . . 0.0 111.306 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.0 tp -84.87 -23.91 28.77 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -168.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -148.96 -65.19 0.23 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.398 1.879 . . . . 0.0 110.601 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 177.27 139.95 3.49 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 -169.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.7 62.46 5.54 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 117.521 0.661 . . . . 0.0 112.355 -167.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -92.24 -155.04 0.4 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.44 40.44 20.76 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 120.843 -1.161 . . . . 0.0 113.894 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -75.51 50.48 0.54 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.092 1.357 . . . . 0.0 108.901 169.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 67.29 -42.28 0.43 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.182 1.793 . . . . 0.0 112.023 -167.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -42.26 -70.49 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.955 2.102 . . . . 0.0 113.216 -173.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 p -65.41 -40.46 93.41 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.54 -0.725 . . . . 0.0 110.409 -174.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.1 mm -54.37 -41.31 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.167 0.987 . . . . 0.0 110.712 173.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.5 m -68.62 -48.37 64.25 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.482 -0.761 . . . . 0.0 109.782 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -58.81 -33.65 70.62 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.756 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.18 -52.29 36.12 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 126.216 1.806 . . . . 0.0 110.531 174.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -60.6 -23.8 64.98 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.62 0.768 . . . . 0.0 112.455 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.03 -6.32 55.67 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 0.0 112.463 169.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.77 41.15 32.13 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 127.075 2.15 . . . . 0.0 112.095 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.29 -7.18 24.85 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.8 mt -83.73 50.53 1.82 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.753 1.16 . . . . 0.0 111.176 -175.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 42.62 31.23 0.28 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.897 2.879 . . . . 0.0 116.038 170.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 t80 67.84 -50.81 0.52 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.21 1.804 . . . . 0.0 113.019 -174.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -38.45 -53.46 1.54 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.593 1.957 . . . . 0.0 112.786 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.88 -49.02 19.09 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 mtp -47.78 -47.2 30.81 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.626 1.571 . . . . 0.0 110.699 -174.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.5 t -59.17 -34.37 72.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.688 0.795 . . . . 0.0 113.106 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -85.37 -36.03 21.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.007 0.908 . . . . 0.0 110.124 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -62.93 -38.74 92.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.223 1.009 . . . . 0.0 110.661 -178.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -53.04 -64.08 1.9 Allowed Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.797 176.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -58.46 -39.02 87.37 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.027 1.818 . . . . 0.0 111.679 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -53.18 -52.58 58.35 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.877 0.762 . . . . 0.0 111.182 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.8 mt -69.35 -36.52 76.95 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.706 -0.621 . . . . 0.0 111.99 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -57.56 -49.76 75.33 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.835 0.743 . . . . 0.0 109.045 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -63.74 -42.24 97.91 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.529 0.332 . . . . 0.0 110.137 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.5 t90 -52.84 -47.04 68.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.217 0.462 . . . . 0.0 110.585 170.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -51.12 70.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -47.53 74.33 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.044 0.538 . . . . 0.0 110.335 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -59.13 -52.88 63.8 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.437 0.695 . . . . 0.0 110.575 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.51 -48.62 74.36 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.219 0.607 . . . . 0.0 110.181 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.883 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 t70 . . . . . 0 N--CA 1.451 -0.42 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.91 -15.19 28.43 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.149 0.431 . . . . 0.0 111.504 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -48.99 -47.71 44.04 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.387 1.075 . . . . 0.0 110.855 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -57.53 -45.86 84.53 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.349 0.26 . . . . 0.0 110.988 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.53 -53.12 61.31 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 124.573 1.149 . . . . 0.0 110.832 -175.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -57.66 11.83 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.216 0.462 . . . . 0.0 110.581 -177.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -54.93 -49.48 71.22 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -55.44 -50.61 69.37 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.341 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.72 -51.9 64.16 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.348 0.976 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp -59.77 -38.38 81.69 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.0 m -64.9 -44.7 88.72 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 121.706 -0.622 . . . . 0.0 109.78 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.52 -48.76 68.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.736 1.214 . . . . 0.0 109.544 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.95 -45.49 92.46 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 174.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.11 -45.35 83.5 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.013 -1.054 . . . . 0.0 111.247 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -60.95 -44.58 97.07 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 121.547 -0.721 . . . . 0.0 110.576 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -50.09 -48.97 52.95 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.657 0.783 . . . . 0.0 110.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -61.25 -51.26 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 122.951 0.5 . . . . 0.0 110.047 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -56.44 -41.39 76.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.892 0.769 . . . . 0.0 112.228 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.88 -12.06 61.19 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.698 0.799 . . . . 0.0 111.752 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.79 33.39 87.12 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -173.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -79.27 116.35 19.47 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 58.8 p -81.16 58.23 3.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.858 1.263 . . . . 0.0 110.071 -168.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 54.27 -75.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.75 2.42 . . . . 0.0 112.788 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -52.93 -27.73 30.23 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.374 0.988 . . . . 0.0 112.22 175.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -54.02 -40.33 66.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.568 0.684 . . . . 0.0 111.117 173.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -58.43 -52.22 61.92 Favored 'Isoleucine or valine' 0 C--N 1.342 0.244 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 172.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.96 -50.54 15.19 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 123.454 0.549 . . . . 0.0 111.885 174.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.7 tp -59.51 -57.57 12.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 117.723 0.762 . . . . 0.0 111.107 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.35 97.29 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.103 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.413 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 66.9 mmm -55.34 -44.1 75.6 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.762 -0.586 . . . . 0.0 110.052 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.76 -57.83 5.1 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 124.728 1.156 . . . . 0.0 111.299 169.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -57.44 -50.17 73.88 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 35.2 mt -83.37 -25.61 31.23 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -169.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -145.88 -61.37 0.33 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.55 1.14 . . . . 0.0 111.046 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 166.11 137.48 2.22 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 107.641 -2.184 . . . . 0.0 107.641 -169.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.07 36.44 0.23 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -167.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -83.33 38.51 0.61 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.096 -1.003 . . . . 0.0 111.414 -172.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -152.75 42.79 0.63 Allowed 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 124.377 1.071 . . . . 0.0 109.671 -169.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 p -56.2 -62.05 1.97 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 170.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -154.43 -47.64 0.09 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.474 1.11 . . . . 0.0 111.106 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -47.66 -67.07 0.31 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.969 1.308 . . . . 0.0 114.295 -169.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 12.5 p -56.79 -49.43 75.35 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.047 0.939 . . . . 0.0 110.341 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.4 mm -53.89 -47.74 63.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.753 1.221 . . . . 0.0 110.909 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.9 m -60.02 -48.17 82.81 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.226 -0.921 . . . . 0.0 110.121 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -59.11 -31.15 68.66 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.165 0.586 . . . . 0.0 111.298 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.62 -57.62 7.7 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 124.092 0.957 . . . . 0.0 110.051 174.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.33 -26.45 68.77 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.87 -6.92 59.24 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.665 0.666 . . . . 0.0 112.428 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.9 mp 48.03 49.39 17.26 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.706 2.003 . . . . 0.0 113.082 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.0 -32.1 27.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.657 0.783 . . . . 0.0 110.678 174.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 42.0 mt -81.18 46.17 0.9 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.825 0.85 . . . . 0.0 112.511 -168.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 m -21.93 85.35 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 129.28 3.032 . . . . 0.0 116.568 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.3 t80 69.25 -57.37 0.53 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.352 2.261 . . . . 0.0 114.025 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -46.09 -51.54 13.67 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.465 1.506 . . . . 0.0 112.519 -172.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -46.47 30.27 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtt -46.95 -44.37 19.93 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.944 1.298 . . . . 0.0 111.715 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.3 t -60.72 -29.82 69.59 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -84.49 -47.49 10.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.273 1.035 . . . . 0.0 109.245 172.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.1 -40.58 70.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.164 1.786 . . . . 0.0 111.764 -175.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -60.58 -66.9 1.25 Allowed Pre-proline 0 CA--C 1.536 0.414 0 CA-C-O 117.995 -1.003 . . . . 0.0 111.039 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.61 -40.14 80.35 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.193 1.929 . . . . 0.0 111.726 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.04 -57.02 11.79 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.255 0.622 . . . . 0.0 111.299 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.1 mt -69.53 -35.0 75.05 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -58.71 -49.81 76.22 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.996 0.816 . . . . 0.0 110.131 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -44.94 90.65 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.413 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 76.7 t90 -50.96 -48.82 60.92 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.165 -0.335 . . . . 0.0 110.843 172.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.19 -51.86 67.23 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.78 -46.01 74.36 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.768 0.427 . . . . 0.0 110.316 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.66 -53.08 61.82 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.113 0.565 . . . . 0.0 110.489 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.63 73.29 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.227 0.611 . . . . 0.0 110.204 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.675 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 110.602 -0.147 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -45.4 -39.96 7.55 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.35 1.46 . . . . 0.0 112.239 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -45.46 -47.59 13.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.004 0.922 . . . . 0.0 111.255 174.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.41 -47.31 84.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -52.22 60.66 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.222 1.009 . . . . 0.0 111.572 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -53.35 57.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.511 1.051 . . . . 0.0 110.974 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -59.88 -40.88 90.21 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.881 -0.512 . . . . 0.0 110.93 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -54.4 -51.17 65.7 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 121.717 -0.614 . . . . 0.0 109.98 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.64 -46.89 77.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.728 0.694 . . . . 0.0 111.821 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.2 -40.91 82.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.311 0.576 . . . . 0.0 111.036 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.7 m -63.28 -43.85 96.73 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.49 -0.756 . . . . 0.0 109.668 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -60.94 -45.22 95.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.551 1.141 . . . . 0.0 110.174 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -49.14 -52.16 27.94 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.143 0.429 . . . . 0.0 110.262 170.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -59.83 -50.87 72.11 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.797 -0.564 . . . . 0.0 111.257 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -55.85 -48.83 74.82 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.559 0.618 . . . . 0.0 110.59 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.3 ttp85 -52.84 -47.61 67.62 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 110.61 176.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 67.2 mt -60.11 -46.58 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.116 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -58.2 -40.88 82.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.191 0.905 . . . . 0.0 111.276 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.23 -13.1 59.79 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.933 -0.479 . . . . 0.0 112.112 173.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.87 27.74 73.59 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -88.99 113.59 24.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -174.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.4 p -77.52 35.55 0.19 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.933 1.693 . . . . 0.0 112.986 -168.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 63.08 -57.97 0.16 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.641 1.976 . . . . 0.0 112.267 -172.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -45.99 -41.45 10.76 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.016 0.817 . . . . 0.0 111.802 170.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -54.71 -51.48 65.46 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 117.507 0.654 . . . . 0.0 110.889 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.1 t -57.7 -45.34 86.75 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.96 -51.18 25.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 123.686 0.66 . . . . 0.0 112.226 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.54 -50.96 65.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.97 0.908 . . . . 0.0 110.85 -178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.63 79.06 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.534 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 66.3 mmm -55.13 -47.41 75.09 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.075 0.95 . . . . 0.0 110.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.57 -53.29 3.61 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.212 1.387 . . . . 0.0 111.472 170.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -66.08 -55.05 18.46 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -75.29 -34.58 61.32 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -168.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -133.32 -56.59 0.91 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.422 1.089 . . . . 0.0 110.864 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.67 152.54 6.93 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 107.609 -2.197 . . . . 0.0 107.609 -170.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.05 65.77 5.32 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.169 0.985 . . . . 0.0 111.71 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -92.04 177.91 6.03 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.99 -1.855 . . . . 0.0 105.99 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 70.81 21.35 5.18 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.041 0.937 . . . . 0.0 112.882 168.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.3 m -75.01 73.06 2.19 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 169.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 72.41 -69.62 0.18 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 126.517 1.927 . . . . 0.0 112.312 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -46.4 -60.41 2.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.834 1.254 . . . . 0.0 112.159 -168.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.5 m -60.5 -31.55 70.58 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.605 0.762 . . . . 0.0 112.595 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -73.89 -40.8 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 119.013 0.824 . . . . 0.0 109.626 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.0 t -58.94 -53.59 56.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 171.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -58.29 -42.64 87.04 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.486 0.715 . . . . 0.0 111.261 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.1 -62.36 1.68 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 124.294 1.038 . . . . 0.0 109.95 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -62.7 -35.89 81.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.507 -174.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.63 -8.68 44.29 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.43 40.08 27.6 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.998 1.319 . . . . 0.0 110.559 -173.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -79.8 -32.79 40.79 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.574 0.75 . . . . 0.0 110.361 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 mt -81.24 45.19 0.83 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.556 0.742 . . . . 0.0 110.828 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.6 m -15.54 77.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 130.311 3.444 . . . . 0.0 116.763 -169.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.0 t80 69.22 -57.11 0.53 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.501 1.92 . . . . 0.0 114.249 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -39.04 -55.61 1.55 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.712 2.005 . . . . 0.0 113.363 -174.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -73.85 -52.67 12.24 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 122.07 0.938 . . . . 0.0 108.601 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.8 mtp -48.37 -38.57 19.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.537 1.535 . . . . 0.0 113.593 -170.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.78 -30.39 71.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -83.14 -42.28 17.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.607 0.718 . . . . 0.0 109.459 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.262 0.1 OUTLIER -62.86 -37.94 88.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.608 0.763 . . . . 0.0 112.407 -172.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -54.6 -67.21 0.7 Allowed Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.959 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.45 -41.58 74.65 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.328 2.019 . . . . 0.0 111.421 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.26 -49.86 51.92 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.935 0.494 . . . . 0.0 111.274 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 mt -67.65 -42.66 81.9 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 118.953 0.797 . . . . 0.0 111.77 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -55.52 -48.55 74.48 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -62.9 -44.78 95.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.762 0.425 . . . . 0.0 110.843 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -52.53 -49.41 64.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.429 0.559 . . . . 0.0 110.264 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.4 -47.78 77.88 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.986 0.914 . . . . 0.0 109.012 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -50.86 -56.75 10.77 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.134 0.492 . . . . 0.0 110.547 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -60.4 -42.96 97.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.52 0.728 . . . . 0.0 110.217 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -88.83 31.88 0.83 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.133 0.973 . . . . 0.0 111.187 174.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 123.949 0.9 . . . . 0.0 110.83 -176.264 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp -53.01 -40.89 64.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.011 0.524 . . . . 0.0 111.508 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -57.06 -57.08 14.14 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.66 -38.81 92.52 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 119.717 -0.182 . . . . 0.0 111.297 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.8 mt -58.48 -44.79 89.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.073 173.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.88 -52.18 64.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.197 0.908 . . . . 0.0 108.932 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.46 -53.89 48.15 Favored 'General case' 0 CA--C 1.529 0.135 0 O-C-N 122.146 -0.346 . . . . 0.0 110.147 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -52.08 -49.13 64.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.945 1.298 . . . . 0.0 110.351 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.53 -51.87 68.05 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.309 0.644 . . . . 0.0 111.173 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -57.21 -45.77 83.53 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.721 0.772 . . . . 0.0 110.005 175.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 m -61.01 -31.51 71.13 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.73 -0.606 . . . . 0.0 110.164 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -62.24 -28.96 70.06 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.308 -0.87 . . . . 0.0 110.987 175.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -65.48 -50.54 64.97 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 121.406 -0.809 . . . . 0.0 110.016 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -58.65 -40.88 84.73 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.954 -0.466 . . . . 0.0 110.496 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.4 mtm180 -67.28 -43.49 81.65 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.401 0.68 . . . . 0.0 110.862 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 42.9 mtm180 -49.27 -55.56 12.27 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.08 0.855 . . . . 0.0 109.895 169.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.72 -50.77 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -54.54 -44.6 73.0 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.249 0.62 . . . . 0.0 111.48 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.0 -9.19 58.03 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.04 29.29 74.37 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.067 0.849 . . . . 0.0 111.124 -171.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -96.14 166.18 11.87 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.591 1.156 . . . . 0.0 109.821 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.2 t -146.34 176.62 9.64 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -57.59 -50.71 72.24 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.49 1.116 . . . . 0.0 111.248 -168.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.21 -45.73 92.36 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -65.16 -44.87 87.12 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.81 0.444 . . . . 0.0 110.03 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.08 -48.47 78.92 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 171.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.67 -54.59 8.87 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.781 0.705 . . . . 0.0 111.423 173.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 tp -60.4 -54.85 40.69 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.645 0.778 . . . . 0.0 111.054 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.13 -47.14 84.21 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.758 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -43.6 83.79 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.84 -0.537 . . . . 0.0 109.962 173.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.93 -55.7 6.22 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.827 1.203 . . . . 0.0 111.35 169.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.26 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.8 mt -85.66 -25.02 26.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -169.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -143.88 -64.52 0.37 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.117 1.367 . . . . 0.0 110.72 -174.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.97 143.06 3.71 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -171.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.18 71.95 8.18 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -172.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -107.48 26.91 9.67 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.528 0.731 . . . . 0.0 111.865 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -142.75 21.95 1.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -169.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 59.2 m -68.85 84.88 0.32 Allowed 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 169.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.282 4.2 pm0 58.25 -62.89 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 129.507 3.123 . . . . 0.0 113.806 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.3 m -33.46 -70.72 0.07 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.092 2.557 . . . . 0.0 112.953 -175.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 m -59.27 -38.76 80.89 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.091 1.357 . . . . 0.0 112.408 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.38 -35.51 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 122.977 0.511 . . . . 0.0 110.086 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -65.94 -50.41 64.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -56.25 -36.9 69.07 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.745 0.818 . . . . 0.0 111.278 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -60.36 -59.53 5.25 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.865 0.866 . . . . 0.0 110.054 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -56.42 -41.17 75.93 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.499 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.36 -3.45 24.06 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . 0.289 0.6 OUTLIER 40.56 51.82 2.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 127.236 2.214 . . . . 0.0 113.175 -170.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -79.39 -43.79 22.73 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.384 1.074 . . . . 0.0 110.838 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -80.22 58.65 3.1 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.699 0.8 . . . . 0.0 110.623 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.1 m -27.56 91.97 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 129.262 3.025 . . . . 0.0 116.121 -171.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 53.2 t80 67.49 -58.68 0.42 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.252 2.221 . . . . 0.0 114.63 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -44.13 -50.55 8.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.571 1.548 . . . . 0.0 112.56 -173.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.4 -54.51 12.13 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.694 0.759 . . . . 0.0 109.287 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.02 -43.41 19.53 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.669 1.588 . . . . 0.0 112.478 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.46 -32.36 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -83.5 -44.02 15.15 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.721 0.772 . . . . 0.0 109.262 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.5 tp -57.42 -42.16 81.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.278 1.031 . . . . 0.0 112.099 -176.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -58.68 -61.51 7.55 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.41 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -58.95 -38.77 86.28 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.721 1.614 . . . . 0.0 111.251 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tt -53.14 -54.13 40.28 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.865 0.757 . . . . 0.0 111.402 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.79 -39.12 87.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.797 0.439 . . . . 0.0 111.333 177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -58.69 -47.35 84.81 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.547 0.612 . . . . 0.0 109.856 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -64.31 -45.69 86.85 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.09 0.556 . . . . 0.0 110.143 177.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -50.95 -48.02 60.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.645 0.26 . . . . 0.0 110.425 173.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -51.41 69.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.422 1.089 . . . . 0.0 109.426 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -45.69 77.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.99 -54.6 35.76 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.85 76.17 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.293 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 CA--C 1.533 0.295 0 CA-C-O 121.161 0.505 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.9 mt -52.44 -40.66 62.48 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.442 0.697 . . . . 0.0 112.327 -176.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.77 -39.65 52.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.563 0.745 . . . . 0.0 111.687 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -79.52 -48.08 14.48 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -53.13 -46.99 69.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.462 0.705 . . . . 0.0 111.71 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.09 -60.06 4.15 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.069 0.85 . . . . 0.0 111.658 -176.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -48.29 -52.05 23.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.862 175.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -54.46 -51.23 65.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.034 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.23 -52.71 63.45 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.84 0.746 . . . . 0.0 110.69 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -57.04 -46.41 82.44 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.574 0.702 . . . . 0.0 110.711 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.5 m -60.56 -39.76 89.13 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 123.112 0.565 . . . . 0.0 110.274 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -58.62 -49.15 78.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.934 0.893 . . . . 0.0 109.196 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -56.49 -52.74 63.59 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 122.446 -0.159 . . . . 0.0 110.908 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -52.74 -53.48 47.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.779 0.432 . . . . 0.0 110.666 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -54.63 -54.01 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.77 0.828 . . . . 0.0 110.187 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.0 ptt85 -63.19 -36.8 84.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.987 -0.446 . . . . 0.0 110.985 -174.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 73.8 mt -55.2 -56.03 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 170.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -55.13 -41.31 71.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.131 0.423 . . . . 0.0 111.683 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.6 mt -73.1 -14.7 61.44 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.76 20.61 77.59 Favored Glycine 0 CA--C 1.533 1.157 0 O-C-N 121.343 -0.848 . . . . 0.0 111.368 -170.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -86.19 74.5 10.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.481 1.134 . . . . 0.0 109.272 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 t -146.16 -168.84 3.1 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.036 -1.438 . . . . 0.0 109.677 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 64.73 -66.45 0.13 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 128.047 2.539 . . . . 0.0 111.018 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.17 -6.13 0.4 Allowed Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.366 0.984 . . . . 0.0 113.122 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.03 -56.98 12.89 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 119.069 1.435 . . . . 0.0 111.273 -171.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.0 t -58.23 -50.37 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -177.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -53.76 10.84 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 175.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.18 -52.82 52.62 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.545 0.738 . . . . 0.0 111.018 -174.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.82 -47.71 83.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.455 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.57 85.41 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 121.978 -0.451 . . . . 0.0 109.916 173.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.72 -56.55 4.97 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 125.218 1.39 . . . . 0.0 111.131 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -61.88 -51.77 66.83 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 87.5 mt -77.12 -29.11 54.61 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -168.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -143.51 -63.34 0.4 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.491 1.517 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.12 145.75 4.74 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.63 71.08 7.49 Favored 'General case' 0 N--CA 1.461 0.115 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -172.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -107.69 19.96 19.46 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.597 0.759 . . . . 0.0 111.9 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -143.63 33.02 1.28 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -168.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.4 m -72.2 75.05 0.97 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 169.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 68.07 -62.22 0.36 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 127.589 2.356 . . . . 0.0 112.765 172.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -30.33 -77.85 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 128.319 2.648 . . . . 0.0 113.104 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 m -55.62 -38.21 69.2 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.791 0.836 . . . . 0.0 111.938 -174.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -66.74 -44.43 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 m -57.59 -43.71 84.86 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.065 -1.022 . . . . 0.0 109.629 172.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -64.57 -33.06 75.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.184 0.993 . . . . 0.0 111.901 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -63.37 -53.66 49.09 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 109.659 172.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -37.23 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.81 -14.92 63.21 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.057 -0.402 . . . . 0.0 111.827 171.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.0 mt 59.59 42.96 16.51 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.611 1.964 . . . . 0.0 111.604 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -78.5 -31.62 47.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.836 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.78 5.12 0.23 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -169.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.6 m 40.4 58.94 2.19 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.073 1.749 . . . . 0.0 114.549 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.2 t80 68.41 -58.08 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.008 2.123 . . . . 0.0 114.529 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -47.14 -51.45 18.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.864 1.266 . . . . 0.0 112.885 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.2 -43.38 42.69 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.8 mtt -46.82 -45.24 19.98 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 124.54 1.136 . . . . 0.0 111.421 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 t -60.83 -29.31 69.41 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -177.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -83.09 -45.98 13.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.993 0.902 . . . . 0.0 109.387 171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -56.04 -44.28 78.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.932 1.693 . . . . 0.0 111.963 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -60.95 -59.92 12.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.516 -0.755 . . . . 0.0 111.785 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -58.6 -41.21 66.54 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.421 1.414 . . . . 0.0 111.217 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -49.99 -54.35 20.61 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 175.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.7 mt -68.93 -35.31 76.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.773 -0.579 . . . . 0.0 111.565 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -56.66 -50.05 73.23 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.409 0.55 . . . . 0.0 109.597 174.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -60.5 -49.04 79.14 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.921 0.489 . . . . 0.0 110.02 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 67.6 t90 -49.23 -50.01 40.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.033 0.379 . . . . 0.0 111.009 174.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -48.48 75.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -175.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.32 -42.64 74.01 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 123.075 0.55 . . . . 0.0 111.139 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.52 -51.35 57.59 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.423 0.289 . . . . 0.0 111.116 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.48 -53.26 11.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.735 0.814 . . . . 0.0 112.163 -169.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 125.238 1.415 . . . . 0.0 111.951 -169.93 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp -49.86 -37.2 29.94 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.613 1.165 . . . . 0.0 110.807 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 55.5 mp0 -49.54 -40.12 36.97 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.566 1.546 . . . . 0.0 111.594 175.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.97 -49.98 14.24 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.9 mt -59.25 -44.88 92.36 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.885 0.474 . . . . 0.0 111.593 -172.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -64.86 -56.78 11.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.237 0.542 . . . . 0.0 111.0 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -48.46 -54.55 13.76 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.892 1.277 . . . . 0.0 110.293 172.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -51.45 -53.14 40.11 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.62 -52.1 60.96 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.548 0.339 . . . . 0.0 110.654 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -61.5 -28.38 69.26 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.584 -0.697 . . . . 0.0 111.84 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.3 m -69.76 -43.59 71.93 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.017 -1.052 . . . . 0.0 108.968 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.48 -42.04 81.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.553 0.741 . . . . 0.0 109.829 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -55.25 -56.25 22.09 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.027 -0.42 . . . . 0.0 110.113 172.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.71 -45.53 81.79 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.929 -0.482 . . . . 0.0 111.07 -178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -53.24 -53.75 46.2 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.196 0.598 . . . . 0.0 110.105 174.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.2 mtm105 -53.62 -55.89 21.93 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.445 0.298 . . . . 0.0 110.817 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.1 mm -51.7 -51.68 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.992 0.917 . . . . 0.0 109.111 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.55 -40.5 71.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.392 0.277 . . . . 0.0 111.363 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.6 mt -86.57 -2.32 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.53 25.07 71.33 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 121.092 -1.005 . . . . 0.0 112.6 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -79.42 102.12 8.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -178.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 33.3 p -148.82 -67.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.447 -164.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -36.02 -43.26 0.32 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.267 2.227 . . . . 0.0 113.207 173.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 147.61 22.17 0.09 OUTLIER Glycine 0 CA--C 1.528 0.868 0 C-N-CA 123.87 0.747 . . . . 0.0 112.88 176.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -51.66 -58.24 6.93 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.487 1.143 . . . . 0.0 110.315 175.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -55.5 -45.7 78.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.97 -49.89 28.38 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 123.302 0.477 . . . . 0.0 112.762 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.26 -56.15 23.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.312 0.645 . . . . 0.0 109.925 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.07 -54.58 37.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.945 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 80.1 mmm -54.69 -44.19 73.15 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.714 1.206 . . . . 0.0 110.468 174.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -42.95 -56.09 4.59 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 125.328 1.442 . . . . 0.0 111.566 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.92 -49.85 64.25 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.765 0.283 . . . . 0.0 111.724 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.76 -34.56 64.77 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.434 ' HH ' ' HZ1' ' A' ' 69' ' ' LYS . 98.3 m-85 -134.78 -59.61 0.8 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.472 1.109 . . . . 0.0 110.93 -172.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.47 146.24 4.61 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 -171.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -81.89 69.59 8.61 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 117.646 0.723 . . . . 0.0 111.422 -169.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -106.41 -155.05 0.53 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 165.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 66.43 -82.13 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.975 0.91 . . . . 0.0 110.61 168.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m 45.05 -72.94 0.0 OUTLIER 'General case' 0 C--N 1.339 0.126 0 C-N-CA 130.011 3.324 . . . . 0.0 115.432 172.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -159.14 -50.33 0.06 Allowed 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.9 p -56.37 -72.28 0.08 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.244 1.017 . . . . 0.0 110.735 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.3 m -55.9 -37.55 69.04 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.494 0.718 . . . . 0.0 111.217 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.75 -42.68 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.618 -0.676 . . . . 0.0 111.871 172.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.4 m -65.23 -43.26 92.01 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.487 -0.758 . . . . 0.0 110.517 173.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -54.69 -47.4 73.72 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.609 0.64 . . . . 0.0 110.456 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -55.75 -59.18 5.23 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.898 1.279 . . . . 0.0 110.439 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -55.09 -38.17 67.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.1 0.96 . . . . 0.0 112.508 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.03 -8.95 58.85 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.254 1.022 . . . . 0.0 112.625 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 58.05 47.79 14.16 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.273 1.429 . . . . 0.0 110.784 -175.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.01 -47.91 15.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.052 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.14 96.57 1.09 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.9 p -68.12 81.55 0.22 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.565 0.746 . . . . 0.0 111.039 -174.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 78.4 t80 75.53 -48.56 0.61 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.97 2.108 . . . . 0.0 113.341 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -35.78 -61.52 0.47 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.504 1.922 . . . . 0.0 112.415 -169.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -79.78 -44.77 20.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.779 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.7 mtp -42.7 -45.52 4.75 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 125.028 1.331 . . . . 0.0 112.094 -174.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.1 t -60.64 -34.07 73.73 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -79.03 -44.47 22.15 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.082 0.944 . . . . 0.0 109.36 174.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -35.1 75.32 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.056 1.342 . . . . 0.0 113.406 -170.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -58.69 -61.62 7.33 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-O 117.769 -1.11 . . . . 0.0 112.395 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -58.74 -40.15 75.53 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.676 1.584 . . . . 0.0 110.982 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -51.66 -52.51 47.47 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.099 0.96 . . . . 0.0 111.387 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.1 mt -71.24 -33.89 70.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.558 -0.714 . . . . 0.0 111.525 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -57.68 -47.23 82.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HZ1' ' HH ' ' A' ' 38' ' ' TYR . 6.3 mtpm? -59.01 -47.83 83.78 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 177.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -51.11 -47.82 61.85 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.913 0.324 . . . . 0.0 110.565 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.49 94.68 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -41.08 81.06 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.878 0.471 . . . . 0.0 110.259 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -68.16 -52.66 32.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.919 0.39 . . . . 0.0 110.442 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.76 -34.81 64.87 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.328 1.051 . . . . 0.0 112.23 -171.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 124.99 1.316 . . . . 0.0 110.722 -175.354 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp -51.85 -41.58 61.93 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.382 0.673 . . . . 0.0 111.064 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -52.09 -42.4 63.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.432 0.693 . . . . 0.0 111.197 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -37.92 62.64 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.846 -0.534 . . . . 0.0 109.82 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.55 -46.36 89.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.445 -0.788 . . . . 0.0 111.476 178.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -58.77 -58.49 8.36 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.77 1.168 . . . . 0.0 111.175 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -46.22 -54.41 8.83 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.707 0.803 . . . . 0.0 110.189 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.24 -49.96 65.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.461 1.105 . . . . 0.0 111.087 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.23 -53.77 54.35 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.521 0.6 . . . . 0.0 110.496 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -56.91 -43.04 80.98 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.314 0.578 . . . . 0.0 110.751 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.2 m -60.99 -48.01 83.82 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -54.7 -47.29 73.88 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.379 0.672 . . . . 0.0 110.052 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.44 -47.36 82.01 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.204 0.456 . . . . 0.0 111.276 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.81 -44.78 82.32 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.903 -0.498 . . . . 0.0 111.001 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.4 mmt-85 -59.59 -46.15 89.8 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.607 0.639 . . . . 0.0 110.883 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -54.7 -46.99 74.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.34 0.656 . . . . 0.0 110.596 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt -61.26 -50.15 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.348 0.659 . . . . 0.0 109.812 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -47.44 67.36 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.822 0.849 . . . . 0.0 110.329 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -67.42 -12.97 61.55 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.751 0.82 . . . . 0.0 112.353 178.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.33 33.87 86.25 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -92.58 82.0 4.82 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.999 0.904 . . . . 0.0 108.972 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.5 t -110.1 -175.69 2.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.583 1.953 . . . . 0.0 108.808 -173.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 60.78 -71.02 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 128.017 2.527 . . . . 0.0 110.074 -175.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -171.32 38.23 0.17 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.901 1.239 . . . . 0.0 110.46 169.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.96 -51.31 70.15 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.028 1.414 . . . . 0.0 110.603 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -51.44 -46.48 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 172.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -55.47 -45.81 82.79 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 118.109 0.413 . . . . 0.0 112.517 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.99 -51.64 66.07 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 121.643 0.735 . . . . 0.0 110.41 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.1 85.51 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.752 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -42.23 80.3 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 124.097 0.959 . . . . 0.0 109.841 172.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -56.91 5.71 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 125.358 1.456 . . . . 0.0 111.154 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.65 -51.12 70.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.74 0.27 . . . . 0.0 111.615 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 mt -81.59 -25.21 35.93 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 115.135 1.531 . . . . 0.0 115.135 -168.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -143.31 -63.11 0.4 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.772 1.229 . . . . 0.0 111.133 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.27 145.28 5.18 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.79 56.5 3.08 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 117.839 0.82 . . . . 0.0 112.51 -167.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -88.6 -175.74 5.04 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 168.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 68.51 40.41 1.94 Allowed 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.972 -1.08 . . . . 0.0 112.634 169.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.3 p -74.96 52.5 0.55 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.965 1.306 . . . . 0.0 109.906 171.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 64.88 -44.86 0.33 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.541 1.936 . . . . 0.0 113.532 -169.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.1 p -44.12 -68.48 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.529 1.932 . . . . 0.0 111.864 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -35.54 73.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.843 0.857 . . . . 0.0 111.323 -174.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.0 mm -64.41 -46.67 92.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.257 0.623 . . . . 0.0 109.507 174.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.1 m -56.52 -45.6 81.0 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.983 -1.073 . . . . 0.0 110.22 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -57.04 -41.48 78.74 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.064 -0.397 . . . . 0.0 111.572 174.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -58.26 -52.61 64.86 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 122.973 0.509 . . . . 0.0 110.298 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.33 -27.47 69.05 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.8 -8.19 56.85 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.573 0.624 . . . . 0.0 111.87 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.31 42.14 25.38 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.987 1.715 . . . . 0.0 110.352 -171.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -79.77 -38.14 33.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.653 -173.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 mt -80.45 56.12 2.47 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.948 0.899 . . . . 0.0 112.873 -169.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.2 m 21.7 53.57 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 130.861 3.664 . . . . 0.0 116.94 169.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.1 t80 65.25 -57.32 0.3 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.321 2.249 . . . . 0.0 114.016 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -38.95 -53.09 1.77 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.447 1.899 . . . . 0.0 113.235 -175.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -72.7 -58.02 3.67 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.501 0.667 . . . . 0.0 109.217 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.3 mtp -44.1 -44.79 7.78 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.724 2.01 . . . . 0.0 112.256 -173.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.33 -31.62 72.9 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.811 0.845 . . . . 0.0 112.613 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -82.16 -37.83 25.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 171.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.071 0.948 . . . . 0.0 110.983 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -51.25 -68.32 0.4 Allowed Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.645 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.33 -37.63 94.22 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.862 1.708 . . . . 0.0 111.524 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -53.63 -54.06 43.01 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.678 0.672 . . . . 0.0 111.293 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 57.0 mt -67.65 -37.96 83.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 121.851 -0.531 . . . . 0.0 111.241 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -57.09 -49.97 74.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.349 0.522 . . . . 0.0 109.856 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -66.43 -42.61 87.43 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 122.246 -0.284 . . . . 0.0 110.482 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -50.59 -49.45 56.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.965 0.348 . . . . 0.0 110.173 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.24 -50.68 69.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -178.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -39.71 61.89 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.637 0.775 . . . . 0.0 111.15 178.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -71.82 -52.41 17.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 117.859 0.3 . . . . 0.0 110.82 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.85 -42.33 94.98 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.151 0.98 . . . . 0.0 112.354 -170.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 . . . . . 0 CA--C 1.53 0.204 0 C-N-CA 124.459 1.103 . . . . 0.0 110.756 -176.146 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.345 0.117 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp -47.38 -40.01 16.61 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.106 0.963 . . . . 0.0 110.709 175.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -49.87 -44.78 50.04 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.328 1.451 . . . . 0.0 111.776 174.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.01 -51.58 37.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.0 mt -53.4 -48.83 68.32 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.787 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -59.27 -61.65 2.47 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.066 0.848 . . . . 0.0 111.247 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -50.62 -52.69 37.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.725 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.52 -50.45 65.42 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.131 0.572 . . . . 0.0 111.1 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -53.1 61.77 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.393 0.677 . . . . 0.0 110.899 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -55.11 -47.02 75.58 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.319 0.58 . . . . 0.0 109.804 177.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.8 m -62.72 -39.09 92.96 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 123.238 0.615 . . . . 0.0 110.579 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -60.02 -51.39 69.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.208 1.003 . . . . 0.0 108.885 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -56.7 -53.69 54.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.398 0.279 . . . . 0.0 110.814 175.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.45 -52.64 53.06 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.662 -0.649 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -62.55 -48.06 81.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.371 0.668 . . . . 0.0 110.761 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 -57.64 -44.15 85.4 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.67 0.668 . . . . 0.0 109.451 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 84.9 mt -59.19 -47.76 89.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 O-C-N 122.081 -0.387 . . . . 0.0 110.003 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -56.36 -40.24 74.19 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.65 0.659 . . . . 0.0 111.503 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.2 mt -72.68 -1.39 16.12 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.48 25.49 74.11 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 121.236 -0.915 . . . . 0.0 111.664 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -91.39 101.51 14.19 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.871 0.868 . . . . 0.0 108.879 -178.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.4 p -76.68 39.38 0.21 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.889 2.076 . . . . 0.0 112.729 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 71.15 -56.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.796 2.038 . . . . 0.0 111.928 176.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -53.29 -40.93 61.38 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -49.11 -55.73 11.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.531 0.732 . . . . 0.0 110.799 173.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.7 t -58.09 -56.05 18.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.68 -49.05 12.53 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-N 118.095 0.407 . . . . 0.0 112.25 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.88 -52.56 65.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.709 1.204 . . . . 0.0 110.049 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.59 -47.72 78.94 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.844 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 48.3 mmm -56.15 -46.31 79.31 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 121.695 -0.628 . . . . 0.0 109.637 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -41.49 -56.65 3.45 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 125.546 1.545 . . . . 0.0 111.662 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -65.36 -50.41 65.65 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.361 0.665 . . . . 0.0 111.801 -178.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.89 -48.18 66.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.163 0.438 . . . . 0.0 111.959 -174.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.41 -56.09 1.42 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.246 1.019 . . . . 0.0 111.154 -169.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.28 152.53 6.29 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 107.934 -2.066 . . . . 0.0 107.934 -169.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -81.02 54.35 2.19 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.887 -0.773 . . . . 0.0 111.076 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.69 -15.1 61.24 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.885 -0.51 . . . . 0.0 111.501 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.78 43.8 1.74 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.104 1.762 . . . . 0.0 107.725 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.6 p -61.65 -62.8 1.55 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.838 0.855 . . . . 0.0 110.349 -169.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.453 ' NE2' ' H ' ' A' ' 45' ' ' THR . 0.2 OUTLIER -161.48 -55.31 0.05 OUTLIER 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.199 0.599 . . . . 0.0 112.226 178.688 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.453 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -57.96 -52.93 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.407 1.083 . . . . 0.0 109.423 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 p -55.03 -51.53 66.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.184 0.994 . . . . 0.0 111.67 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -59.39 -46.98 92.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 O-C-N 122.02 -0.425 . . . . 0.0 110.71 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.0 m -56.43 -50.5 71.47 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.938 0.875 . . . . 0.0 110.77 175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -62.03 -30.1 70.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.765 1.226 . . . . 0.0 111.454 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -61.23 -57.4 12.56 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.176 0.591 . . . . 0.0 109.796 173.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.07 -30.52 68.13 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.61 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.34 -7.45 59.07 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.05 36.95 13.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.14 1.776 . . . . 0.0 112.106 -171.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -80.19 -31.57 38.74 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.844 -0.535 . . . . 0.0 111.861 -175.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -79.11 53.53 1.46 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.718 0.807 . . . . 0.0 111.554 -175.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.7 m -5.23 71.57 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 130.407 3.483 . . . . 0.0 116.49 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.7 t80 66.64 -57.81 0.39 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.938 2.095 . . . . 0.0 114.262 174.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.8 -55.56 3.6 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.517 1.527 . . . . 0.0 113.734 -169.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.18 -46.92 39.05 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 57.4 mtp -50.82 -42.11 58.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.342 1.457 . . . . 0.0 111.273 -173.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.4 t -64.36 -28.42 69.69 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.782 0.833 . . . . 0.0 112.663 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -82.7 -45.06 14.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.863 0.839 . . . . 0.0 109.425 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.267 0.1 OUTLIER -59.84 -46.92 87.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.819 1.247 . . . . 0.0 112.609 -178.249 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -55.12 -58.3 15.55 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -59.73 -34.81 95.96 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.848 1.698 . . . . 0.0 111.488 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 mp -63.69 -45.35 90.45 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 19.1 mt -62.9 -39.63 95.11 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 173.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.64 -50.37 74.1 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.899 0.772 . . . . 0.0 109.361 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.65 -47.8 81.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.358 0.663 . . . . 0.0 110.27 175.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -53.02 -43.45 66.56 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 122.228 -0.295 . . . . 0.0 110.487 174.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.88 -46.78 80.32 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -39.64 73.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.028 0.531 . . . . 0.0 110.611 176.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.52 -58.1 4.06 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.94 0.496 . . . . 0.0 111.537 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.77 -37.75 62.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.601 1.16 . . . . 0.0 112.158 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 . . . . . 0 C--O 1.233 0.219 0 C-N-CA 125.038 1.335 . . . . 0.0 111.748 -178.247 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.773 0.32 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp -50.91 -43.6 59.89 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.422 0.689 . . . . 0.0 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.4 mp0 -49.84 -45.43 50.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.198 1.399 . . . . 0.0 111.05 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.21 -48.36 57.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -55.79 -54.04 49.26 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.414 0.686 . . . . 0.0 111.444 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.04 -56.59 20.24 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-N 119.027 0.831 . . . . 0.0 111.137 -177.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.38 -54.88 18.5 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -54.21 -48.96 70.45 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.904 0.482 . . . . 0.0 110.744 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -52.37 65.81 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.142 0.977 . . . . 0.0 111.066 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -59.42 -46.97 87.21 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.627 -0.67 . . . . 0.0 110.122 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.8 m -60.71 -38.42 84.99 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 122.022 -0.423 . . . . 0.0 110.129 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.39 -46.28 90.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.847 0.859 . . . . 0.0 109.171 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -56.21 -50.67 70.6 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.266 0.484 . . . . 0.0 110.444 174.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -56.86 -48.5 77.97 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.162 -0.961 . . . . 0.0 110.885 178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -57.55 -42.37 82.84 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.934 -0.479 . . . . 0.0 111.061 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -54.64 -49.08 71.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.489 1.115 . . . . 0.0 110.349 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.2 mm -61.71 -48.82 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.233 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.95 -44.43 87.0 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.259 0.481 . . . . 0.0 111.389 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.2 mt -64.43 -37.98 89.44 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.255 0.622 . . . . 0.0 110.35 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.55 34.36 6.08 Favored Glycine 0 CA--C 1.525 0.719 0 C-N-CA 124.369 0.985 . . . . 0.0 111.348 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -79.42 74.97 6.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 122.938 1.351 . . . . 0.0 108.258 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.1 t -57.05 145.04 32.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.467 3.507 . . . . 0.0 111.765 -168.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 56.01 -77.71 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.029 1.732 . . . . 0.0 109.725 -172.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -160.9 46.56 0.39 Allowed Glycine 0 CA--C 1.523 0.558 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 169.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -61.53 -14.72 31.89 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.237 1.019 . . . . 0.0 111.952 -175.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.0 t -42.42 -43.46 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 124.28 1.032 . . . . 0.0 109.259 167.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.42 -45.63 16.68 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.125 0.869 . . . . 0.0 113.566 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.6 tp -70.07 -52.79 21.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.725 0.774 . . . . 0.0 109.87 -176.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.97 80.99 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.386 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.7 mmm -53.92 -47.3 71.33 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 110.318 170.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.48 -54.2 3.38 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 125.308 1.432 . . . . 0.0 111.461 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.62 -53.14 37.41 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 mt -76.15 -31.94 58.83 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -168.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -135.63 -56.69 0.79 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.461 1.105 . . . . 0.0 110.52 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.83 156.17 8.63 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -170.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.66 74.12 5.2 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.839 0.82 . . . . 0.0 110.489 -169.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -109.38 159.91 16.61 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 73.74 33.88 0.98 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.509 1.123 . . . . 0.0 113.771 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.4 m -75.05 65.29 1.45 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 64.05 -59.15 0.2 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.163 2.185 . . . . 0.0 112.5 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.1 p -32.19 -66.28 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.002 1.721 . . . . 0.0 113.081 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.17 -30.93 71.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.922 0.889 . . . . 0.0 112.383 -177.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 26.0 mm -67.15 -49.06 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.2 m -52.45 -53.61 43.18 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.579 -0.701 . . . . 0.0 110.373 173.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -59.36 -37.81 78.82 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.616 0.766 . . . . 0.0 111.364 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -61.37 -60.3 3.93 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.268 0.627 . . . . 0.0 110.039 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.26 -41.59 76.05 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.12 -11.98 58.7 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 55.39 46.59 23.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.303 1.441 . . . . 0.0 110.911 -173.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -79.92 -41.12 26.73 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.439 1.095 . . . . 0.0 110.929 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.3 mt -77.91 -162.23 0.31 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.3 m -154.73 173.29 16.62 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 120.772 -1.205 . . . . 0.0 109.104 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -41.53 0.86 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.07 2.548 . . . . 0.0 112.07 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -39.61 -39.48 0.75 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.131 1.372 . . . . 0.0 112.023 176.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -104.75 -56.02 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.685 1.594 . . . . 0.0 109.743 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.0 mtt -47.15 -39.52 13.8 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.128 1.771 . . . . 0.0 113.945 -170.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.0 t -66.42 -25.31 66.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -90.03 -40.28 12.41 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -43.23 77.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.332 0.653 . . . . 0.0 111.814 -178.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -54.02 -65.77 1.12 Allowed Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 118.978 -0.534 . . . . 0.0 112.216 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -58.78 -40.75 69.69 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.891 1.728 . . . . 0.0 111.655 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 tt -49.19 -51.99 29.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 111.172 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.55 -40.21 80.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 121.775 -0.578 . . . . 0.0 111.275 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -61.68 -44.7 96.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.453 1.024 . . . . 0.0 110.259 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -61.65 -46.67 88.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.716 -0.615 . . . . 0.0 109.812 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -50.79 -46.58 59.7 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.791 0.269 . . . . 0.0 110.32 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.75 -48.85 79.93 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.761 0.824 . . . . 0.0 109.239 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.25 -48.82 77.88 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -57.6 -48.57 79.03 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.15 0.58 . . . . 0.0 109.64 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.5 33.38 0.7 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.61 1.164 . . . . 0.0 110.993 176.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 124.169 0.988 . . . . 0.0 110.937 -176.71 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.2 t0 . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp -41.6 -48.77 4.09 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 125.006 1.322 . . . . 0.0 111.484 -177.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -45.67 -47.53 15.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.241 1.416 . . . . 0.0 112.003 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -74.32 -49.66 21.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.73 -48.99 71.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.366 0.667 . . . . 0.0 111.496 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -61.19 -61.13 2.78 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.615 0.643 . . . . 0.0 110.843 -178.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -51.38 -48.28 62.61 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.413 0.685 . . . . 0.0 110.509 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -54.72 -51.83 64.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.763 0.425 . . . . 0.0 110.48 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.38 -52.83 58.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.35 0.523 . . . . 0.0 111.274 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -54.5 -46.45 73.47 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.896 0.379 . . . . 0.0 110.017 177.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.0 m -59.75 -42.54 93.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.821 0.449 . . . . 0.0 110.383 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -60.64 -44.87 95.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.844 0.458 . . . . 0.0 109.917 177.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -59.3 -48.92 79.81 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.724 -0.61 . . . . 0.0 111.079 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -55.45 -50.26 70.31 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.249 0.62 . . . . 0.0 110.141 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -52.01 -55.63 19.31 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.373 173.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -53.19 -49.27 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 110.439 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.1 mt -60.39 -44.94 97.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.539 0.736 . . . . 0.0 110.128 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -57.92 -41.37 82.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.749 0.704 . . . . 0.0 111.075 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.09 -10.81 59.95 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 173.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.15 73.88 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -94.62 154.96 17.1 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.623 0.769 . . . . 0.0 109.901 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -178.59 -174.83 0.4 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 -172.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 16.38 -84.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 129.12 2.968 . . . . 0.0 114.186 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 -33.36 40.62 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.927 -0.93 . . . . 0.0 113.479 -170.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -67.43 -70.86 0.23 Allowed 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.462 1.631 . . . . 0.0 112.809 -167.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.2 t -55.66 -41.02 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.9 -52.77 24.81 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.097 0.856 . . . . 0.0 112.993 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 tp -72.32 -47.52 49.1 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 117.997 0.898 . . . . 0.0 110.639 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.63 -51.71 64.55 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.288 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 62.4 mtp -64.56 -37.6 88.11 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 121.895 -0.503 . . . . 0.0 110.699 170.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -37.83 -56.75 1.68 Allowed Glycine 0 C--O 1.229 -0.206 0 C-N-CA 126.083 1.801 . . . . 0.0 111.262 172.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -76.1 -45.94 31.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.6 tp -72.02 -16.49 62.06 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -170.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -153.81 -64.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.856 1.662 . . . . 0.0 111.097 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.94 149.08 6.03 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 -169.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.93 67.77 8.05 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 117.746 0.773 . . . . 0.0 111.137 -168.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -121.76 170.73 9.46 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.501 1.52 . . . . 0.0 107.53 171.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 62.26 45.06 7.07 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.305 1.042 . . . . 0.0 111.44 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -62.53 -59.09 5.44 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.2 1.0 . . . . 0.0 109.072 169.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.59 -51.38 0.06 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.64 1.576 . . . . 0.0 108.849 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.9 p -50.63 -58.67 5.3 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.353 1.061 . . . . 0.0 111.742 -175.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.38 78.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.7 1.2 . . . . 0.0 111.1 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.8 mm -63.82 -56.54 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.799 0.84 . . . . 0.0 109.239 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.9 m -50.33 -45.38 54.82 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.215 -0.928 . . . . 0.0 111.275 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -60.8 -37.48 82.09 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -59.0 -55.49 34.46 Favored 'General case' 0 CA--C 1.522 -0.114 0 CA-C-N 118.71 0.687 . . . . 0.0 109.699 172.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.04 -31.46 70.0 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.8 -2.57 40.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.177 0.591 . . . . 0.0 112.421 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mp 53.52 35.75 21.59 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.88 1.672 . . . . 0.0 112.252 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -31.53 50.83 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.99 39.68 0.51 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.961 0.904 . . . . 0.0 109.937 176.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.8 m -37.83 94.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 128.864 2.866 . . . . 0.0 115.567 -167.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.9 t80 69.2 -56.89 0.54 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 128.197 2.599 . . . . 0.0 113.63 173.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -39.72 -51.6 2.33 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.535 1.934 . . . . 0.0 112.83 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -47.53 14.98 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.7 mtt -44.24 -40.09 4.91 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.458 1.903 . . . . 0.0 112.847 -169.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 24.2 t -65.07 -25.97 68.04 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 118.473 -1.291 . . . . 0.0 112.912 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -90.17 -45.16 9.28 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 169.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -42.28 79.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 125.143 1.377 . . . . 0.0 112.476 -174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.6 -62.0 6.83 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.362 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.96 -38.35 92.5 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.342 1.361 . . . . 0.0 111.735 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.31 -55.49 27.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.642 0.777 . . . . 0.0 111.449 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.38 -37.45 83.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 121.074 -1.016 . . . . 0.0 111.254 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -58.5 -47.85 82.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.594 -0.691 . . . . 0.0 109.276 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -61.55 -44.05 97.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.359 0.663 . . . . 0.0 110.085 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.7 t90 -52.49 -49.29 65.02 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.769 0.713 . . . . 0.0 110.563 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.25 -48.55 77.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.549 0.74 . . . . 0.0 109.427 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -56.55 -45.13 81.4 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 122.687 0.395 . . . . 0.0 110.654 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.67 -47.55 85.74 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.978 0.511 . . . . 0.0 110.86 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.54 -45.38 91.95 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.466 0.706 . . . . 0.0 110.998 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 . . . . . 0 CA--C 1.531 0.248 0 C-N-CA 124.278 1.031 . . . . 0.0 111.27 176.436 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.342 0.115 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.64 -40.4 62.74 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.165 0.586 . . . . 0.0 111.373 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -50.3 -37.17 35.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.572 1.149 . . . . 0.0 111.875 173.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -83.86 -45.01 13.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.986 0.514 . . . . 0.0 110.381 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.15 -46.87 62.16 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.657 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -57.76 -63.53 1.21 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.133 0.879 . . . . 0.0 111.511 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -55.7 -46.01 77.76 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.551 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.06 -52.41 64.37 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.98 0.512 . . . . 0.0 110.093 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.27 74.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.886 -0.509 . . . . 0.0 109.946 -177.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -56.19 -33.98 65.8 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.969 -0.457 . . . . 0.0 111.569 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.3 m -69.52 -40.43 76.93 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 121.469 -0.769 . . . . 0.0 109.449 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.27 -41.57 84.58 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -57.81 -51.6 68.93 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.97 -0.456 . . . . 0.0 110.814 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -55.57 -48.16 75.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.102 0.561 . . . . 0.0 110.417 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.67 -46.77 86.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.335 0.654 . . . . 0.0 110.771 176.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 mtm105 -55.15 -50.22 69.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.813 -0.554 . . . . 0.0 110.99 174.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.9 mt -54.71 -51.25 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -54.51 -45.36 73.28 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 122.678 0.391 . . . . 0.0 111.358 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 mt -74.16 -17.74 60.87 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.658 0.783 . . . . 0.0 112.368 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.02 32.19 72.99 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.051 0.834 . . . . 0.0 111.07 -170.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -95.01 124.34 39.0 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.811 0.844 . . . . 0.0 111.088 -173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -166.77 -168.83 1.2 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 -172.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 55.68 -73.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.553 2.341 . . . . 0.0 111.48 -173.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -167.46 34.88 0.21 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 124.141 0.877 . . . . 0.0 111.304 170.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.12 -53.13 59.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.486 1.143 . . . . 0.0 108.77 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.3 -48.46 32.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.939 170.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -49.99 17.63 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.275 0.94 . . . . 0.0 112.095 176.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 tp -62.39 -53.35 56.27 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.802 0.841 . . . . 0.0 110.702 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.94 78.12 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.366 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtp -55.39 -43.01 74.8 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 123.768 0.827 . . . . 0.0 110.233 169.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.24 -53.76 6.57 Favored Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.456 1.503 . . . . 0.0 111.73 168.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -62.65 -48.8 77.74 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.409 0.283 . . . . 0.0 111.373 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.65 -48.36 22.44 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -125.12 -62.47 1.22 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.358 1.863 . . . . 0.0 112.952 -168.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.52 138.49 2.73 Favored Glycine 0 CA--C 1.531 1.089 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.52 59.15 4.5 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.506 0.722 . . . . 0.0 111.593 -167.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.57 -20.0 19.34 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -172.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -101.78 78.6 1.83 Allowed 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -166.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.5 t -73.47 171.14 13.7 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 165.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.28 -38.61 42.0 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -54.17 -57.76 9.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.569 1.147 . . . . 0.0 111.854 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -41.49 92.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.62 0.768 . . . . 0.0 110.109 -176.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -59.27 -43.2 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 122.015 -0.428 . . . . 0.0 110.966 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.2 m -59.12 -43.24 91.93 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 118.692 0.678 . . . . 0.0 110.093 174.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -47.87 61.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.611 0.364 . . . . 0.0 110.815 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -62.93 -54.93 30.89 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 122.37 0.268 . . . . 0.0 111.624 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.51 -23.24 66.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.096 0.958 . . . . 0.0 113.11 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.26 -7.62 59.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.844 0.858 . . . . 0.0 111.186 169.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp 52.24 44.34 29.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 126.387 1.875 . . . . 0.0 110.019 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -79.52 -33.58 41.9 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.024 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.5 mt -78.35 46.09 0.6 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.878 0.871 . . . . 0.0 112.621 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.3 t 60.77 -76.59 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.067 2.147 . . . . 0.0 113.179 174.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.1 t80 176.28 -47.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 126.554 1.942 . . . . 0.0 107.795 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -54.03 2.73 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.562 1.545 . . . . 0.0 112.995 -176.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -76.24 -56.45 4.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 37.9 mtp -38.33 -49.04 1.39 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.438 2.295 . . . . 0.0 112.178 -178.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.13 -41.7 84.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.0 0.92 . . . . 0.0 112.589 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -77.68 -34.72 52.81 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.3 0.64 . . . . 0.0 109.902 175.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -50.89 65.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.084 1.353 . . . . 0.0 110.511 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -46.2 -64.14 1.06 Allowed Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.26 -34.82 98.12 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 121.973 1.782 . . . . 0.0 111.837 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.61 -51.99 66.24 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.57 -39.24 90.46 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.652 0.381 . . . . 0.0 111.283 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.15 -51.86 67.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.941 -0.474 . . . . 0.0 110.182 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.14 -43.5 98.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.7 0.4 . . . . 0.0 110.157 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -52.59 -45.29 66.44 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 172.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.11 -46.56 80.53 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.66 -40.92 66.31 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.985 0.514 . . . . 0.0 110.59 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -70.03 -55.3 9.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.769 0.428 . . . . 0.0 111.543 177.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.36 -46.05 51.44 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.17 0.988 . . . . 0.0 112.766 -169.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 . . . . . 0 CA--C 1.53 0.173 0 C-N-CA 125.68 1.592 . . . . 0.0 112.963 -172.139 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -44.01 -45.37 7.86 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 125.305 1.442 . . . . 0.0 112.356 -170.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -37.24 -51.75 1.04 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.116 1.366 . . . . 0.0 111.455 174.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.22 -48.73 78.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.795 0.838 . . . . 0.0 110.05 -178.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.42 -48.32 82.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.431 1.092 . . . . 0.0 110.155 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.09 -58.16 9.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.716 0.769 . . . . 0.0 109.896 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -56.32 -51.51 67.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.511 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -51.53 -52.86 43.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 110.822 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -53.48 44.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.032 0.833 . . . . 0.0 110.708 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -67.25 -12.54 60.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.2 m -90.29 -38.19 13.56 Favored 'General case' 0 C--O 1.228 -0.076 0 C-N-CA 124.129 0.972 . . . . 0.0 109.537 175.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -53.05 -44.83 67.72 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.848 0.859 . . . . 0.0 108.885 173.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -48.58 -56.86 7.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.245 0.618 . . . . 0.0 111.602 169.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -60.4 -49.38 77.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 O-C-N 121.991 -0.443 . . . . 0.0 110.483 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -55.95 -52.09 65.39 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.895 0.316 . . . . 0.0 110.188 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -50.99 -50.56 58.19 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.252 1.021 . . . . 0.0 110.786 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -59.98 -51.43 72.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.085 0.554 . . . . 0.0 110.253 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.23 -40.71 82.44 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.591 0.632 . . . . 0.0 111.532 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.5 mt -67.8 -16.3 64.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.696 0.799 . . . . 0.0 111.449 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.57 29.77 74.3 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -173.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -90.63 108.29 19.71 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.932 0.872 . . . . 0.0 109.147 -174.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 65.4 p -67.92 168.6 11.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.019 1.327 . . . . 0.0 109.859 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.67 -40.16 65.7 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 169.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.01 -55.32 29.82 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 173.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -56.03 -56.42 20.97 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 117.429 0.614 . . . . 0.0 110.735 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.6 t -59.17 -46.55 92.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.64 -52.6 24.23 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.9 tp -60.08 -54.47 45.6 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 123.518 0.727 . . . . 0.0 110.808 -178.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.85 91.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.127 -176.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.416 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 73.9 mmm -56.83 -45.15 82.51 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.803 -0.561 . . . . 0.0 110.084 171.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.54 -55.72 5.17 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 124.916 1.246 . . . . 0.0 111.224 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 tptp -52.93 -48.85 67.01 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.652 0.781 . . . . 0.0 112.293 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.6 mt -90.01 -35.91 15.24 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -169.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -132.57 -59.26 0.91 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.259 1.423 . . . . 0.0 110.889 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.98 142.69 3.46 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 107.85 -2.1 . . . . 0.0 107.85 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -79.41 38.36 0.36 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.309 1.054 . . . . 0.0 113.314 -168.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.56 39.11 0.59 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.463 -0.773 . . . . 0.0 111.134 -174.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -144.19 31.14 1.25 Allowed 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 125.51 1.524 . . . . 0.0 108.996 -169.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.7 m -76.66 67.25 2.74 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.488 1.115 . . . . 0.0 108.163 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 75.15 -48.0 0.62 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.524 1.929 . . . . 0.0 113.124 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.5 p -49.23 -79.41 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.075 1.35 . . . . 0.0 112.266 -172.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.2 p -54.31 -44.97 72.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.404 1.082 . . . . 0.0 110.525 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.34 -53.62 37.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.716 0.806 . . . . 0.0 111.202 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.8 p -60.35 -48.88 79.85 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.775 -0.578 . . . . 0.0 110.15 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -58.27 -34.95 71.06 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.423 . . . . 0.0 111.984 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -69.43 -53.05 21.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 123.629 0.772 . . . . 0.0 110.307 178.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -55.6 -40.25 71.82 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.832 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.88 -10.79 59.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.359 1.064 . . . . 0.0 112.838 173.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.4 mt 58.74 45.66 15.36 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 127.121 2.168 . . . . 0.0 112.767 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.32 -30.45 30.45 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.844 1.258 . . . . 0.0 111.119 176.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -80.26 47.92 0.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.981 0.912 . . . . 0.0 113.094 -168.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 m -16.99 84.31 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 129.545 3.138 . . . . 0.0 116.82 -171.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.2 t80 66.05 -58.08 0.34 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.714 2.406 . . . . 0.0 114.725 172.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -44.25 -50.54 8.84 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.612 1.565 . . . . 0.0 112.379 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -47.07 21.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.0 mtt -45.6 -46.15 14.17 Favored 'General case' 0 C--O 1.225 -0.237 0 C-N-CA 125.22 1.408 . . . . 0.0 111.636 -174.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.9 t -64.82 -22.78 67.06 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -174.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -90.04 -46.87 8.21 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.369 1.08 . . . . 0.0 108.696 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.23 -38.74 77.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.971 1.708 . . . . 0.0 111.734 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -61.39 -63.04 4.77 Favored Pre-proline 0 N--CA 1.452 -0.327 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.16 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -58.1 -39.94 81.27 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 CA-C-N 120.869 1.346 . . . . 0.0 111.181 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.62 -57.23 11.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.18 0.592 . . . . 0.0 111.433 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.2 mt -69.43 -34.11 73.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -58.38 -49.53 76.91 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.018 0.827 . . . . 0.0 109.08 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -62.29 -43.75 98.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.416 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 67.0 t90 -53.16 -49.53 66.42 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 117.906 0.321 . . . . 0.0 110.978 172.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -50.62 72.5 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -174.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -54.31 -53.01 59.62 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.37 0.668 . . . . 0.0 110.84 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -56.42 -51.87 66.76 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.378 0.671 . . . . 0.0 110.969 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.4 -49.39 76.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.312 0.645 . . . . 0.0 110.207 178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 173.83 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.7 t0 . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp -43.25 -40.81 3.61 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.403 1.881 . . . . 0.0 112.912 -169.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -40.15 -42.37 1.45 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.991 1.716 . . . . 0.0 112.467 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -74.59 -48.93 23.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.588 0.755 . . . . 0.0 110.244 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.11 -45.67 90.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.747 0.819 . . . . 0.0 111.088 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -57.43 -60.33 3.81 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.381 0.992 . . . . 0.0 111.04 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -56.91 -46.42 81.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.224 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -54.44 -48.6 71.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.329 0.513 . . . . 0.0 111.042 176.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.8 -51.41 67.19 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.614 1.166 . . . . 0.0 110.465 -176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -57.15 -45.28 83.73 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.502 0.668 . . . . 0.0 109.563 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.1 m -64.26 -32.18 73.67 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.909 -0.494 . . . . 0.0 110.494 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -63.28 -48.07 79.67 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.764 1.166 . . . . 0.0 109.345 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -52.3 -53.01 49.69 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 171.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -59.37 -44.35 92.73 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.649 -0.657 . . . . 0.0 111.81 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -59.12 -48.46 81.52 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.498 0.719 . . . . 0.0 110.312 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 64.9 ttp85 -52.04 -49.38 63.56 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.654 0.782 . . . . 0.0 110.252 175.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.03 -47.4 91.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 122.702 0.401 . . . . 0.0 110.143 178.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -59.26 -41.14 88.09 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.835 0.743 . . . . 0.0 111.604 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.53 -17.66 64.11 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.027 -0.42 . . . . 0.0 111.695 172.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.43 28.46 71.18 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -173.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -88.8 120.09 29.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.47 0.635 . . . . 0.0 109.793 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.39 147.29 51.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 167.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -54.19 -27.97 37.6 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.138 0.575 . . . . 0.0 110.524 170.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.32 -45.62 95.81 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 171.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -64.63 -46.82 80.96 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.4 t -52.93 -52.84 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.07 175.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.37 -49.38 45.15 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.266 0.46 . . . . 0.0 112.262 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.4 tp -62.4 -53.64 51.92 Favored 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 121.701 0.762 . . . . 0.0 110.872 -177.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.97 92.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.745 0.818 . . . . 0.0 110.387 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -44.99 79.52 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.012 0.525 . . . . 0.0 109.747 171.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.08 -58.03 3.93 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.62 1.581 . . . . 0.0 111.352 169.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.8 -52.75 62.92 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.8 mt -75.34 -34.48 61.2 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -134.96 -59.5 0.79 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.087 0.955 . . . . 0.0 111.067 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 170.63 154.72 9.76 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 -171.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.12 68.24 4.11 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 123.604 0.761 . . . . 0.0 110.57 -169.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -112.29 172.69 6.76 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.59 1.956 . . . . 0.0 107.416 173.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 70.73 19.58 5.92 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -72.92 79.51 1.17 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 169.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 64.46 -67.16 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.412 2.285 . . . . 0.0 112.408 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 p -29.09 -75.45 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 127.829 2.452 . . . . 0.0 113.043 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -46.35 74.45 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.769 1.227 . . . . 0.0 111.251 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.6 mm -58.81 -49.92 81.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.484 1.114 . . . . 0.0 109.584 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.9 m -56.35 -54.1 49.47 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.83 -0.544 . . . . 0.0 110.226 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -71.05 -22.0 62.18 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -64.86 -56.26 14.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.07 -38.32 65.16 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 119.336 -0.364 . . . . 0.0 111.608 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.2 3.22 24.5 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mp 48.13 53.63 11.41 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.769 2.027 . . . . 0.0 114.779 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.55 -55.23 5.0 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.781 0.8 . . . . 0.0 111.326 170.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.98 -27.31 61.33 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -167.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m 67.94 164.88 0.23 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.597 1.159 . . . . 0.0 113.354 175.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -44.51 -45.48 9.29 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.178 1.391 . . . . 0.0 112.367 -169.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -36.05 -48.89 0.62 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 126.487 1.915 . . . . 0.0 113.14 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.58 -47.84 6.35 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 44.8 mtt -50.31 -41.43 51.07 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.922 -171.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.59 -21.33 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -176.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -89.22 -45.13 9.78 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.62 -39.74 92.36 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.36 0.664 . . . . 0.0 112.464 -174.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -57.89 -61.68 6.92 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.964 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.35 -39.86 73.2 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.455 1.437 . . . . 0.0 111.341 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 tt -51.5 -52.48 46.42 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.438 0.563 . . . . 0.0 111.155 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.3 -38.74 88.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.67 -0.644 . . . . 0.0 111.398 177.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.1 -48.09 79.46 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.299 0.499 . . . . 0.0 109.703 178.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -69.95 -36.25 75.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.217 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -52.82 -49.12 66.32 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 119.033 0.833 . . . . 0.0 109.644 169.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -52.42 65.73 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.14 -46.61 62.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.641 0.776 . . . . 0.0 110.733 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -64.57 -54.27 34.77 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.007 0.523 . . . . 0.0 110.466 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.77 66.95 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.659 0.783 . . . . 0.0 110.488 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 169.745 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.618 0.247 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp -43.98 -45.37 7.77 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.602 1.161 . . . . 0.0 111.565 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -51.39 -46.47 62.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.047 0.939 . . . . 0.0 111.405 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.8 -53.66 25.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.0 mt -54.59 -49.67 69.84 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.948 0.899 . . . . 0.0 111.876 -172.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.61 -60.95 2.98 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.07 0.85 . . . . 0.0 110.837 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.44 -55.87 11.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.659 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -49.42 -51.86 32.52 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.133 0.573 . . . . 0.0 110.748 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.26 -50.1 73.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.737 -0.602 . . . . 0.0 111.425 -174.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -60.2 -29.62 68.83 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.682 -0.636 . . . . 0.0 110.625 175.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.6 m -73.45 -42.57 61.78 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.476 -0.765 . . . . 0.0 109.44 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -52.26 -52.18 54.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -53.29 -54.93 29.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -55.72 -55.22 34.88 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.865 -0.522 . . . . 0.0 111.178 -178.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -60.49 -46.33 90.51 Favored 'General case' 0 C--O 1.224 -0.244 0 O-C-N 121.988 -0.445 . . . . 0.0 110.99 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -47.99 -51.93 21.86 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.675 1.19 . . . . 0.0 110.858 174.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.8 mt -60.36 -51.6 71.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 122.832 0.453 . . . . 0.0 109.876 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -56.34 -40.43 74.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.792 0.724 . . . . 0.0 112.105 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.47 -15.13 62.78 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.149 0.98 . . . . 0.0 111.565 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.78 19.83 79.74 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 123.754 0.692 . . . . 0.0 111.871 -177.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -85.88 94.55 9.2 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.2 t -61.04 155.75 19.5 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.232 0.539 . . . . 0.0 110.406 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.43 75.55 1.04 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 168.82 -50.72 0.22 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 106.802 -2.519 . . . . 0.0 106.802 -169.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.25 -45.91 91.18 Favored 'General case' 0 C--N 1.341 0.233 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -52.7 -55.15 12.61 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 171.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.41 -49.63 14.95 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.654 0.661 . . . . 0.0 112.04 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.16 -54.37 46.65 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.118 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.24 82.69 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.705 0.802 . . . . 0.0 111.454 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.2 mmm -51.21 -46.13 62.12 Favored 'General case' 0 C--N 1.333 -0.112 0 C-N-CA 125.241 1.416 . . . . 0.0 109.54 169.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -58.1 5.12 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 125.317 1.436 . . . . 0.0 111.882 168.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.45 -50.03 75.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.526 0.33 . . . . 0.0 111.307 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -65.54 -49.41 69.01 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.273 0.488 . . . . 0.0 111.75 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -132.43 -55.42 0.96 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.193 0.997 . . . . 0.0 111.318 -169.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.98 142.26 3.37 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 108.531 -1.827 . . . . 0.0 108.531 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -81.14 74.8 8.13 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.142 0.971 . . . . 0.0 109.397 -174.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -98.02 26.09 5.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.148 167.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -141.99 42.71 1.69 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.27 -0.893 . . . . 0.0 110.073 -168.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.5 m -79.33 173.58 12.44 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -46.88 -44.45 19.63 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.646 0.778 . . . . 0.0 111.834 -171.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 p -48.84 -66.58 0.38 Allowed 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.206 1.402 . . . . 0.0 112.015 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -69.24 -40.7 77.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.714 0.806 . . . . 0.0 111.513 -173.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -61.39 -44.33 98.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.755 -0.591 . . . . 0.0 110.238 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 56.4 m -58.67 -45.06 90.23 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.014 -0.428 . . . . 0.0 110.621 170.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -40.24 66.67 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.541 0.736 . . . . 0.0 111.316 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -66.41 -60.36 2.83 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.311 1.045 . . . . 0.0 110.911 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -62.29 -26.37 68.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.02 8.13 34.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.858 0.863 . . . . 0.0 111.807 172.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp 43.64 36.38 1.23 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 126.752 2.021 . . . . 0.0 113.089 -178.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 -32.59 59.37 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.8 mt -57.76 -14.66 6.16 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.527 0.731 . . . . 0.0 112.183 168.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.2 m 72.58 -65.97 0.33 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.893 1.677 . . . . 0.0 113.728 168.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -169.26 -52.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.465 0.706 . . . . 0.0 110.443 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -37.62 -57.21 0.98 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.256 1.823 . . . . 0.0 113.295 -173.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -81.97 -43.64 17.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.676 0.751 . . . . 0.0 110.159 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 58.7 mtp -43.53 -42.51 5.01 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 125.023 1.329 . . . . 0.0 112.388 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.1 t -63.06 -21.55 66.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -90.7 -47.2 7.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.098 0.959 . . . . 0.0 109.487 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.64 -52.47 6.36 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.202 1.801 . . . . 0.0 110.371 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -61.47 -57.95 21.83 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 117.493 -1.241 . . . . 0.0 112.096 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -44.27 -49.27 8.96 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.43 2.087 . . . . 0.0 112.295 170.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 mp -60.53 -50.44 73.53 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 -172.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mt -64.64 -35.62 81.61 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.07 0.548 . . . . 0.0 111.985 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -62.26 -48.65 78.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -58.25 -46.89 85.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.405 173.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -52.07 -50.21 61.99 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.432 0.56 . . . . 0.0 111.047 175.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -42.26 89.8 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.844 0.458 . . . . 0.0 109.825 -173.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -53.46 -58.98 5.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.125 0.488 . . . . 0.0 109.879 170.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -58.91 -47.5 84.77 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.264 0.626 . . . . 0.0 110.404 -171.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.6 31.22 1.06 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.794 1.238 . . . . 0.0 111.543 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 . . . . . 0 CA--C 1.531 0.214 0 C-N-CA 123.665 0.786 . . . . 0.0 111.02 -178.033 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.532 0.273 0 CA-C-O 120.289 0.09 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.0 mp -42.76 -54.15 4.22 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.398 1.479 . . . . 0.0 111.609 -170.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -51.08 -46.99 61.95 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.597 1.159 . . . . 0.0 111.169 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.2 mp0 -69.33 -43.98 72.6 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.32 -51.47 45.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.79 1.636 . . . . 0.0 112.098 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -56.49 21.35 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.978 0.894 . . . . 0.0 109.637 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -52.31 -53.96 37.64 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.396 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -51.15 -53.11 37.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.65 1.18 . . . . 0.0 111.003 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.4 -48.09 81.79 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.908 0.483 . . . . 0.0 110.463 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.34 -37.29 86.69 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.145 0.498 . . . . 0.0 111.521 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.4 m -65.71 -36.68 84.32 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 121.81 -0.557 . . . . 0.0 109.884 176.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -56.73 -45.1 82.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.393 0.542 . . . . 0.0 111.142 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -59.47 -49.14 78.94 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.036 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -59.28 -46.94 87.18 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.881 -0.512 . . . . 0.0 110.519 -177.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -63.41 -45.01 92.97 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.492 0.717 . . . . 0.0 110.319 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -54.24 -48.24 71.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.506 0.722 . . . . 0.0 110.246 174.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.3 mt -61.9 -40.69 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.051 0.54 . . . . 0.0 109.82 177.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -61.04 -43.17 99.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.446 0.567 . . . . 0.0 111.26 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.27 -37.89 84.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.456 0.571 . . . . 0.0 110.244 170.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.37 35.72 9.32 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 124.637 1.113 . . . . 0.0 110.323 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -103.9 129.81 51.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.477 0.656 . . . . 0.0 109.876 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.5 p -73.07 160.03 32.68 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.148 0.579 . . . . 0.0 110.491 -175.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -72.76 68.1 0.84 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 167.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.96 -58.11 0.11 Allowed Glycine 0 CA--C 1.524 0.646 0 N-CA-C 106.664 -2.574 . . . . 0.0 106.664 -169.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.32 -50.08 74.06 Favored 'General case' 0 C--N 1.34 0.152 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 169.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 70.6 t -55.53 -43.16 71.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 174.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.66 -51.0 51.47 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.71 -52.9 63.5 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.61 0.764 . . . . 0.0 110.292 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.13 74.06 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.711 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -44.85 92.25 Favored 'General case' 0 C--O 1.224 -0.255 0 O-C-N 121.842 -0.536 . . . . 0.0 110.196 175.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.5 -54.29 5.68 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 124.827 1.203 . . . . 0.0 111.374 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -62.56 -50.99 69.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.638 0.375 . . . . 0.0 111.577 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.28 -25.49 36.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -169.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -142.81 -60.74 0.43 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.572 1.149 . . . . 0.0 110.782 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 154.05 139.34 2.82 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 107.021 -2.431 . . . . 0.0 107.021 -169.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -82.24 69.42 8.97 Favored 'General case' 0 C--N 1.337 0.044 0 CA-C-N 118.481 1.141 . . . . 0.0 110.376 -170.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -92.44 35.18 1.02 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.01 0.524 . . . . 0.0 110.441 170.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -134.43 -52.8 0.83 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 121.506 -0.746 . . . . 0.0 111.771 -167.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p 30.36 -98.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.267 2.227 . . . . 0.0 112.567 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tm0? -125.23 -59.96 1.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.807 1.643 . . . . 0.0 108.831 172.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.45 -58.31 7.96 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 123.937 0.895 . . . . 0.0 112.755 -167.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -41.64 99.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.729 0.695 . . . . 0.0 111.342 -177.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -57.59 -47.43 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.964 0.802 . . . . 0.0 110.871 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -63.05 -45.97 89.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.961 -0.462 . . . . 0.0 110.17 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -59.2 -40.43 85.75 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.629 0.772 . . . . 0.0 111.485 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -60.52 -55.46 33.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.153 0.581 . . . . 0.0 109.945 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -59.43 -39.22 82.83 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.645 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.09 -5.85 38.27 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 173.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.9 mt 58.52 42.39 21.0 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.707 2.003 . . . . 0.0 111.825 176.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -79.79 -31.51 40.81 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.846 0.858 . . . . 0.0 111.805 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.55 31.05 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.949 1.462 . . . . 0.0 114.949 -168.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 92.3 p 55.06 -80.54 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.515 2.326 . . . . 0.0 113.595 -178.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -174.74 -38.89 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.612 2.365 . . . . 0.0 109.335 -176.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -44.89 -52.18 8.88 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.616 1.166 . . . . 0.0 112.738 -174.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -76.73 -47.09 22.89 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.7 mtt -41.49 -46.9 3.61 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 125.184 1.394 . . . . 0.0 112.334 -177.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.5 t -61.42 -27.52 68.61 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -82.64 -51.19 7.97 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -45.1 -46.32 11.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.884 2.074 . . . . 0.0 111.799 -176.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -64.26 -64.02 3.23 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.99 -174.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.56 -37.46 96.99 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.476 1.451 . . . . 0.0 111.081 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.98 -56.93 12.31 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.231 0.612 . . . . 0.0 111.027 175.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.9 mt -67.88 -35.56 78.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.103 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.22 -49.75 75.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.834 0.743 . . . . 0.0 109.96 176.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -66.99 -42.01 85.78 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -52.21 -47.55 65.55 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 122.011 -0.43 . . . . 0.0 110.459 170.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -53.42 57.43 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -45.62 -53.56 9.01 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.89 0.876 . . . . 0.0 110.427 174.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.84 -45.71 91.33 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.79 -177.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.63 -51.17 66.41 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.736 0.814 . . . . 0.0 111.134 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 N--CA 1.454 -0.233 0 O-C-N 122.122 -0.361 . . . . 0.0 110.071 -177.126 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 CA--C 1.53 0.195 0 CA-C-O 119.531 -0.271 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -53.97 -36.47 62.9 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.388 0.675 . . . . 0.0 112.558 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -79.87 -49.12 12.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.553 0.615 . . . . 0.0 109.443 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -51.78 -48.85 63.62 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.843 -0.599 . . . . 0.0 111.786 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -55.95 -62.71 1.52 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 118.801 0.728 . . . . 0.0 111.43 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -59.06 -43.62 91.73 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.612 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -56.0 -52.36 64.5 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 110.196 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -52.3 66.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.142 0.977 . . . . 0.0 110.327 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.66 -48.86 63.25 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.81 0.844 . . . . 0.0 109.884 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.6 m -62.29 -45.82 91.54 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.057 0.543 . . . . 0.0 110.64 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -54.91 -45.95 74.81 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.105 0.562 . . . . 0.0 109.568 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.9 -46.14 85.39 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.03 -0.419 . . . . 0.0 111.258 174.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -59.16 -46.79 87.46 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.248 0.931 . . . . 0.0 110.567 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -58.89 -46.45 87.82 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 122.184 -0.322 . . . . 0.0 110.518 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -55.17 -47.12 75.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.544 0.738 . . . . 0.0 110.948 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 81.9 mt -59.54 -46.96 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 123.109 0.563 . . . . 0.0 109.773 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -57.77 -42.02 83.21 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.468 0.576 . . . . 0.0 111.224 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.47 -15.66 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.24 33.04 72.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 -173.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 122.634 1.207 . . . . 0.0 109.091 -174.921 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t0 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 120.504 0.192 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.1 t -50.81 -50.44 23.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.267 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.83 -44.74 55.62 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.452 0.549 . . . . 0.0 112.389 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.41 -52.1 59.86 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 123.819 0.847 . . . . 0.0 110.396 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.33 -57.42 12.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.437 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 10.5 ttm -50.32 -42.49 52.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.546 1.138 . . . . 0.0 111.293 169.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.55 -54.28 6.61 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 124.721 1.153 . . . . 0.0 111.875 170.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -67.19 -49.08 65.92 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.61 0.364 . . . . 0.0 111.459 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.6 mt -71.66 -53.44 13.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.479 0.712 . . . . 0.0 112.49 -169.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -116.45 -58.18 2.11 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.836 1.654 . . . . 0.0 111.142 -169.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.35 152.38 7.61 Favored Glycine 0 CA--C 1.532 1.122 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 -171.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.63 60.91 1.73 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.283 1.433 . . . . 0.0 113.216 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -110.36 174.32 5.92 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.768 1.227 . . . . 0.0 108.029 172.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' HG12 ' A' ' 47' ' ' ILE . 74.9 m-85 66.7 39.88 3.46 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.379 1.072 . . . . 0.0 112.302 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -74.85 57.65 0.79 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.565 1.546 . . . . 0.0 109.855 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 72.53 -53.03 0.7 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.361 1.465 . . . . 0.0 111.25 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -41.66 -70.8 0.1 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 127.761 2.424 . . . . 0.0 111.715 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.96 -32.83 74.24 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.259 0.624 . . . . 0.0 111.461 -171.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.41 HG12 ' HB3' ' A' ' 42' ' ' PHE . 18.2 mm -60.52 -53.56 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 171.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -53.94 -48.37 70.31 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.999 -0.438 . . . . 0.0 110.535 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -56.71 -42.83 79.87 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.498 175.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -57.85 -55.52 33.8 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.876 0.47 . . . . 0.0 110.311 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -57.13 -38.03 72.87 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.551 176.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.28 -1.36 26.21 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.7 mp 51.26 30.58 5.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.231 1.813 . . . . 0.0 112.988 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -83.9 35.22 0.52 Allowed 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.897 -1.127 . . . . 0.0 111.004 -174.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.7 mt -139.86 19.66 2.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.666 1.586 . . . . 0.0 110.513 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.0 m 28.64 60.84 0.13 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.336 2.655 . . . . 0.0 116.029 169.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.2 t80 68.89 -58.59 0.49 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.51 1.924 . . . . 0.0 114.417 171.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -41.3 -56.0 2.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 113.262 -170.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -76.69 -49.69 15.5 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.565 0.698 . . . . 0.0 109.365 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 89.0 mtp -45.12 -44.8 10.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.602 1.561 . . . . 0.0 112.847 -173.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.9 t -59.77 -35.67 75.11 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.9 0.48 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.5 mttp -79.38 -35.97 39.92 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.644 0.778 . . . . 0.0 110.066 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.42 ' C ' HD12 ' A' ' 63' ' ' LEU 0.266 0.0 OUTLIER -65.32 -45.3 84.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.074 0.95 . . . . 0.0 112.132 -178.087 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -44.67 -62.25 1.7 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.212 1.005 . . . . 0.0 113.434 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -60.28 -34.53 93.66 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 121.974 1.783 . . . . 0.0 112.33 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.1 -48.28 80.87 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 mt -64.24 -38.76 92.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 118.108 0.413 . . . . 0.0 111.507 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.09 -51.62 69.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.91 0.777 . . . . 0.0 109.881 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -60.93 -39.06 87.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.545 0.338 . . . . 0.0 110.162 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -56.98 -44.8 83.06 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 121.761 -0.587 . . . . 0.0 109.916 173.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -47.32 86.36 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.921 0.888 . . . . 0.0 109.426 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.96 -46.65 78.53 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.974 0.509 . . . . 0.0 110.915 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -67.37 -51.2 54.99 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.568 1.147 . . . . 0.0 112.204 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 128.29 2.636 . . . . 0.0 113.959 -174.348 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -47.74 -40.6 20.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.66 0.784 . . . . 0.0 111.98 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.35 -43.84 93.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.893 -0.505 . . . . 0.0 109.806 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.98 -49.1 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.426 1.09 . . . . 0.0 110.328 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -54.6 44.55 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.145 0.884 . . . . 0.0 110.882 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -55.14 -51.05 67.7 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -54.88 -49.7 70.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.882 0.473 . . . . 0.0 110.974 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.9 -51.35 67.91 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 110.651 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -62.59 -42.7 99.72 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.936 -0.477 . . . . 0.0 110.725 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.8 m -61.02 -44.94 96.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.174 0.589 . . . . 0.0 110.258 176.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -55.71 -48.33 75.34 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.811 1.244 . . . . 0.0 109.042 176.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -55.31 -45.13 76.33 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.183 173.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -59.18 -49.43 77.88 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.226 0.921 . . . . 0.0 110.645 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -55.29 -47.01 76.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.012 -0.43 . . . . 0.0 110.694 176.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.3 ttp85 -57.8 -45.05 86.65 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 110.949 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.9 mt -61.99 -46.75 95.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 C-N-CA 123.385 0.674 . . . . 0.0 109.822 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.28 -41.01 78.93 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.801 0.728 . . . . 0.0 110.848 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.99 -13.43 62.45 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 173.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.54 29.37 72.91 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 123.891 0.758 . . . . 0.0 111.286 -177.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 . . . . . 0 N--CA 1.455 -0.212 0 CA-C-N 117.448 0.624 . . . . 0.0 109.821 -177.966 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.67 -40.4 79.23 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-O 118.622 -0.704 . . . . 0.0 109.339 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.15 -57.44 6.3 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 174.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.4 tp -60.71 -43.27 98.04 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.561 0.744 . . . . 0.0 109.725 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.574 ' HB1' ' HE1' ' A' ' 70' ' ' TRP . . . -59.52 -37.51 78.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.381 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 31.2 mmm -65.99 -45.98 79.65 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -38.38 -51.05 2.33 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 126.813 2.149 . . . . 0.0 111.919 172.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -57.43 -40.31 78.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.0 mt -99.5 -53.87 3.09 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.671 0.388 . . . . 0.0 111.547 -169.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -112.58 -48.68 2.99 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.709 1.604 . . . . 0.0 110.908 -169.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.02 155.59 6.48 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 108.681 -1.768 . . . . 0.0 108.681 -169.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -76.96 68.27 3.1 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.119 0.96 . . . . 0.0 110.273 -173.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -85.2 -58.45 2.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.346 0.658 . . . . 0.0 109.714 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -93.27 89.84 6.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.999 -0.438 . . . . 0.0 111.868 -168.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 m -100.34 -179.24 4.06 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 169.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -51.25 -36.28 41.17 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.7 p -53.04 -73.59 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.795 0.838 . . . . 0.0 109.82 172.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -43.33 65.74 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.547 1.139 . . . . 0.0 111.807 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.77 -48.04 81.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 O-C-N 121.504 -0.747 . . . . 0.0 111.47 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.7 p -56.01 -45.14 79.17 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.395 -1.441 . . . . 0.0 110.201 174.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -37.07 75.28 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.961 0.504 . . . . 0.0 111.915 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -58.88 -55.45 34.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.139 0.976 . . . . 0.0 110.012 173.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.15 -27.94 69.72 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.12 -4.34 56.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.5 0.72 . . . . 0.0 112.436 171.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp 53.96 31.44 13.47 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.071 2.148 . . . . 0.0 113.996 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -92.25 27.64 2.15 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.538 -0.726 . . . . 0.0 111.494 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 mt -128.85 31.06 5.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.901 1.68 . . . . 0.0 107.887 170.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 m -33.73 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 129.913 3.285 . . . . 0.0 114.704 -168.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 23.0 t80 68.65 -58.24 0.48 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.745 2.418 . . . . 0.0 113.323 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -43.14 -51.71 5.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.902 1.681 . . . . 0.0 113.074 -172.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -81.55 -48.32 11.95 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.9 mtt -43.84 -40.41 4.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 126.195 1.798 . . . . 0.0 112.761 -173.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.7 t -66.94 -23.37 65.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.085 -1.046 . . . . 0.0 113.063 -176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.62 -55.22 3.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.905 0.86 . . . . 0.0 108.701 169.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -48.02 -44.23 30.78 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.109 2.164 . . . . 0.0 112.294 -177.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -63.64 -62.95 4.53 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.436 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.55 -37.01 96.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.205 1.27 . . . . 0.0 111.881 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.0 -49.91 72.83 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.0 mt -61.88 -40.34 95.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.312 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -57.0 -53.7 55.12 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.78 0.718 . . . . 0.0 109.795 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -58.93 -46.02 88.98 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.679 0.392 . . . . 0.0 110.438 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.574 ' HE1' ' HB1' ' A' ' 33' ' ' ALA . 73.4 t90 -54.56 -45.09 73.42 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.479 0.312 . . . . 0.0 110.639 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.83 -44.44 85.55 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.01 -40.05 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.768 0.427 . . . . 0.0 110.503 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.69 -59.47 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.17 0.588 . . . . 0.0 111.488 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.174 0 C-N-CA 124.266 1.026 . . . . 0.0 112.563 -169.4 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 N--CA 1.455 -0.19 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -53.86 -47.51 70.95 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.587 0.355 . . . . 0.0 110.967 173.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -65.55 -43.35 90.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.501 0.721 . . . . 0.0 110.053 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.14 -47.09 81.99 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.737 0.415 . . . . 0.0 110.404 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -56.63 18.96 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.546 0.738 . . . . 0.0 110.298 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -52.27 -54.18 34.51 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.738 0.815 . . . . 0.0 109.077 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -54.95 -49.92 70.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.634 0.774 . . . . 0.0 111.055 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.51 -52.97 60.28 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.159 0.89 . . . . 0.0 110.814 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -60.32 -38.69 84.49 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.49 -0.757 . . . . 0.0 111.132 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 85.7 m -65.2 -44.63 87.73 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.552 -0.717 . . . . 0.0 109.829 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -53.07 -54.06 41.05 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.807 1.243 . . . . 0.0 108.865 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.43 -52.33 62.12 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 177.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -56.65 -54.29 47.74 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.934 -0.479 . . . . 0.0 111.367 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -57.25 -48.32 79.16 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 122.094 -0.379 . . . . 0.0 110.528 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.7 ttp85 -50.79 -50.42 56.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.766 0.826 . . . . 0.0 110.569 176.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.78 -49.26 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 C-N-CA 122.979 0.512 . . . . 0.0 110.023 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -55.48 -42.41 74.32 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.82 0.737 . . . . 0.0 111.239 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.5 mt -68.54 -17.87 64.24 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.377 0.671 . . . . 0.0 112.075 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.93 25.7 75.16 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 122.096 0.95 . . . . 0.0 108.46 -176.739 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 CA--C 1.529 0.146 0 N-CA-C 110.566 -0.161 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.87 -56.31 13.31 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.56 -48.77 34.74 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 123.811 0.72 . . . . 0.0 111.746 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.62 -54.86 29.22 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.451 0.643 . . . . 0.0 110.933 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.63 -48.97 77.98 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.964 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -40.3 81.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.471 0.708 . . . . 0.0 110.413 174.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -46.88 -55.89 8.0 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 125.004 1.287 . . . . 0.0 111.112 169.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -61.42 -48.22 82.17 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -80.99 -28.93 35.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -145.16 -63.53 0.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 111.049 -172.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.87 140.52 3.34 Favored Glycine 0 CA--C 1.529 0.945 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 -169.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.28 61.06 5.31 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 122.112 -0.64 . . . . 0.0 111.351 -168.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -81.64 -151.86 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 64.4 31.9 12.35 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.422 -0.799 . . . . 0.0 112.085 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -76.77 54.2 0.97 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.078 1.751 . . . . 0.0 110.235 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 66.39 -67.36 0.15 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.983 1.713 . . . . 0.0 109.99 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.2 p -28.45 -73.4 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 128.16 2.584 . . . . 0.0 111.838 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.8 m -53.49 -37.85 63.12 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.373 1.869 . . . . 0.0 112.714 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -75.02 -48.96 30.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 121.631 -0.668 . . . . 0.0 109.829 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.9 m -53.95 -48.77 69.94 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.587 -0.696 . . . . 0.0 110.652 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -58.52 -40.76 83.79 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.522 1.129 . . . . 0.0 110.936 176.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.461 ' CE2' HD12 ' A' ' 67' ' ' LEU . 4.2 t80 -57.56 -56.62 19.57 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.311 0.505 . . . . 0.0 110.31 175.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -65.55 -25.28 67.36 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.71 -5.13 44.17 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.058 0.845 . . . . 0.0 112.083 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 50.03 42.39 24.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.508 1.923 . . . . 0.0 111.552 -171.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -79.86 -34.68 39.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.78 0.832 . . . . 0.0 112.005 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.38 52.11 1.55 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.899 0.88 . . . . 0.0 111.931 -169.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 m -24.17 85.43 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.515 3.126 . . . . 0.0 116.757 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 t80 68.43 -57.76 0.48 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.759 2.424 . . . . 0.0 114.224 170.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -43.32 -50.98 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.198 1.799 . . . . 0.0 112.358 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -46.54 22.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.413 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 62.6 mtt -46.81 -44.91 19.68 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.913 1.285 . . . . 0.0 112.136 -172.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 22.2 t -64.39 -22.18 66.87 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -175.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.3 -51.91 5.32 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.063 0.935 . . . . 0.0 108.607 171.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 60' ' ' MET . 28.3 tp -47.1 -45.49 22.17 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 127.669 2.388 . . . . 0.0 112.041 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -63.66 -64.14 3.22 Favored Pre-proline 0 N--CA 1.453 -0.286 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.371 -176.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -56.28 -39.46 91.13 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 CA-C-N 120.87 1.346 . . . . 0.0 111.202 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tt -53.66 -57.7 9.85 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 123.005 0.522 . . . . 0.0 111.563 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 50' ' ' PHE . 83.2 mt -70.75 -31.18 67.91 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.151 0.58 . . . . 0.0 110.958 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.84 -46.17 89.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.73 -41.91 91.65 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.131 -0.356 . . . . 0.0 110.116 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -52.53 -46.73 66.85 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.156 0.434 . . . . 0.0 110.325 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.45 -46.78 86.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.11 -52.17 53.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.806 0.275 . . . . 0.0 110.638 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.79 -54.46 46.87 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.782 0.433 . . . . 0.0 111.709 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.272 0 C-N-CA 124.64 1.176 . . . . 0.0 111.652 -173.458 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 119.719 -0.182 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.31 -54.23 47.89 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.764 0.426 . . . . 0.0 109.966 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.97 -44.32 91.49 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.347 0.659 . . . . 0.0 110.95 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -57.93 -48.07 81.01 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.713 0.405 . . . . 0.0 110.712 176.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -55.84 29.79 Favored 'General case' 0 C--N 1.337 0.05 0 C-N-CA 123.134 0.574 . . . . 0.0 109.658 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -54.23 -51.91 63.0 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.67 0.388 . . . . 0.0 110.262 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -54.43 -53.76 49.89 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.452 0.701 . . . . 0.0 110.688 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.91 92.03 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.756 0.422 . . . . 0.0 111.114 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.5 ttpm? -56.36 -45.43 80.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.766 0.826 . . . . 0.0 109.798 174.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.3 m -63.57 -42.03 98.34 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.064 -0.397 . . . . 0.0 110.808 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -55.46 -51.1 68.06 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.35 -51.91 66.54 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.958 0.503 . . . . 0.0 110.85 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -45.97 88.73 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.745 -0.597 . . . . 0.0 110.421 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -65.98 -45.84 80.22 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.797 0.439 . . . . 0.0 109.848 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.4 ttp85 -50.58 -51.81 44.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 109.988 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 88.3 mt -59.42 -48.54 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.5 -42.46 78.38 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.4 0.546 . . . . 0.0 111.372 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.59 -16.23 63.79 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.7 0.8 . . . . 0.0 111.722 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.7 28.44 73.76 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -176.11 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 119.938 -0.077 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.09 -48.38 89.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -176.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.92 -52.74 24.99 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 118.744 0.702 . . . . 0.0 111.659 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.11 -56.36 21.72 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.843 0.857 . . . . 0.0 110.46 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.73 -45.77 91.16 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.018 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mmm -55.51 -45.99 77.02 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 121.814 -0.554 . . . . 0.0 110.053 170.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.44 -57.08 4.55 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.754 1.168 . . . . 0.0 111.794 169.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -59.25 -50.5 73.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.787 0.293 . . . . 0.0 111.344 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.8 mt -78.14 -29.5 48.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -171.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -146.24 -61.4 0.31 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.127 0.971 . . . . 0.0 111.456 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 164.96 138.7 2.47 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 107.616 -2.193 . . . . 0.0 107.616 -169.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -78.73 38.87 0.33 Allowed 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.665 -0.903 . . . . 0.0 113.268 -168.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -81.38 41.75 0.63 Allowed 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.289 -0.882 . . . . 0.0 111.362 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -147.45 33.81 0.87 Allowed 'General case' 0 CA--C 1.524 -0.033 0 C-N-CA 124.094 0.958 . . . . 0.0 109.971 -169.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.6 m -73.07 64.58 0.73 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.814 1.246 . . . . 0.0 110.266 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 68.96 -60.56 0.45 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.413 1.885 . . . . 0.0 111.972 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 m -45.12 -66.3 0.42 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.9 1.28 . . . . 0.0 111.797 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.49 -41.07 69.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.267 1.027 . . . . 0.0 111.729 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.7 mm -64.73 -43.79 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.483 0.713 . . . . 0.0 109.991 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.6 p -65.42 -43.34 90.84 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.751 -0.593 . . . . 0.0 110.731 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -58.88 -45.94 89.02 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 118.51 0.596 . . . . 0.0 109.707 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -55.73 -57.95 9.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.254 1.022 . . . . 0.0 110.327 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -62.19 -34.99 77.5 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 -3.86 30.06 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 172.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 59.1 28.78 18.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.953 1.701 . . . . 0.0 111.926 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.35 -34.69 58.94 Favored 'General case' 0 C--N 1.333 -0.125 0 O-C-N 121.133 -0.98 . . . . 0.0 109.002 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 68.5 mt -62.98 -5.05 2.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 112.388 170.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.0 m 69.91 -65.16 0.32 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.722 1.609 . . . . 0.0 115.18 166.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -166.18 -53.28 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.826 0.739 . . . . 0.0 111.489 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -46.37 -51.54 14.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.924 0.889 . . . . 0.0 113.202 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -77.73 -52.15 9.4 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.6 mmm -38.04 -51.22 1.38 Allowed 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 126.338 1.855 . . . . 0.0 111.267 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 31.3 t -65.8 -29.28 69.74 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -84.63 -40.39 17.52 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.975 0.893 . . . . 0.0 108.978 175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -67.74 -35.02 77.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.844 1.257 . . . . 0.0 113.584 -176.88 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -50.33 -67.39 0.47 Allowed Pre-proline 0 CA--C 1.536 0.406 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.885 173.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -57.75 -37.03 98.01 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.907 1.738 . . . . 0.0 111.394 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tt -53.6 -55.38 26.27 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.611 0.764 . . . . 0.0 111.117 173.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.3 mt -66.71 -31.9 72.86 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.781 -0.574 . . . . 0.0 112.02 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.09 -47.71 78.98 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.573 -0.704 . . . . 0.0 109.254 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -64.2 -39.98 95.12 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 119.245 -0.407 . . . . 0.0 110.608 175.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 68.8 t90 -52.42 -49.1 65.21 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.459 0.572 . . . . 0.0 110.181 169.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.72 -47.48 85.07 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -175.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.81 -53.27 50.94 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.823 0.449 . . . . 0.0 110.69 175.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.82 -50.09 75.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.674 0.39 . . . . 0.0 111.41 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.238 0 C-N-CA 124.903 1.281 . . . . 0.0 111.449 -175.693 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mp . . . . . 0 CA--C 1.53 0.196 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -52.48 -40.6 62.51 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.935 0.894 . . . . 0.0 111.902 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -70.58 -54.37 12.32 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.5 mt -52.25 -52.96 49.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 112.102 -171.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.18 -59.73 4.28 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.57 0.7 . . . . 0.0 111.588 -174.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -53.24 -60.22 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.411 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -50.6 -50.19 54.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.187 0.995 . . . . 0.0 111.35 -172.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.32 -53.24 60.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.556 0.693 . . . . 0.0 110.476 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -65.49 -22.74 66.76 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.66 -0.65 . . . . 0.0 111.542 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 57.6 m -75.96 -40.38 54.08 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.366 -0.834 . . . . 0.0 109.455 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.62 -48.44 72.21 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 170.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.2 tttp -54.38 -55.65 26.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.699 0.285 . . . . 0.0 111.671 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -57.41 -52.07 66.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.746 -0.596 . . . . 0.0 111.218 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpt85 -60.26 -44.67 95.08 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.161 0.584 . . . . 0.0 110.421 -178.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 58.9 ttp85 -52.72 -49.41 65.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.073 0.949 . . . . 0.0 110.482 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 75.1 mt -59.66 -46.87 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-O 119.128 -0.463 . . . . 0.0 110.059 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -57.02 -42.12 79.82 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.085 0.857 . . . . 0.0 111.299 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.24 -18.42 65.34 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.741 0.416 . . . . 0.0 112.086 174.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.09 24.43 74.6 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 -172.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 122.609 1.195 . . . . 0.0 108.492 -175.667 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t70 . . . . . 0 C--O 1.232 0.181 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.4 t -57.74 -52.43 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.22 -48.51 47.0 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.39 -56.92 15.19 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 117.494 0.647 . . . . 0.0 110.167 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.401 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.03 -46.22 90.22 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.894 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -47.02 60.99 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.957 1.303 . . . . 0.0 109.41 170.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -48.8 -59.15 6.95 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.943 1.259 . . . . 0.0 112.307 169.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.25 -47.81 77.79 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 117.06 0.43 . . . . 0.0 111.409 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.1 mt -73.5 -50.35 21.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 5.9 m-85 -126.3 -59.05 1.33 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.938 0.895 . . . . 0.0 112.0 -168.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 158.55 135.1 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -169.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -82.39 73.6 9.41 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.699 -0.883 . . . . 0.0 110.331 -170.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.79 27.67 2.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.311 167.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -148.13 47.17 1.07 Allowed 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.852 -0.53 . . . . 0.0 110.403 -167.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.2 p -60.04 -59.88 4.71 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.921 0.888 . . . . 0.0 109.154 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -159.29 -54.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.062 1.345 . . . . 0.0 109.029 -177.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.0 p -48.69 -69.74 0.11 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.414 1.485 . . . . 0.0 111.023 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.2 m -49.12 -49.14 43.48 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.22 1.408 . . . . 0.0 111.363 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.6 mm -60.21 -47.8 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.993 0.917 . . . . 0.0 110.533 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m -62.59 -48.19 80.54 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.205 -0.309 . . . . 0.0 110.475 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -36.88 82.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.284 0.634 . . . . 0.0 110.925 178.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -63.6 -52.28 61.61 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 118.671 0.669 . . . . 0.0 110.639 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -58.22 -33.25 69.11 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.661 0.784 . . . . 0.0 112.082 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.47 8.89 22.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.066 0.946 . . . . 0.0 112.373 172.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.5 mp 36.83 44.88 0.38 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.64 2.376 . . . . 0.0 113.459 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -85.52 -53.05 5.43 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.713 1.205 . . . . 0.0 108.955 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.87 101.61 0.22 Allowed 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.11 -179.89 1.36 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.053 1.741 . . . . 0.0 114.357 -167.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -40.53 -46.79 2.56 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.825 1.65 . . . . 0.0 113.906 -169.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -41.46 -46.16 3.37 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.249 1.42 . . . . 0.0 112.555 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -79.02 -58.43 3.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.69 0.796 . . . . 0.0 108.886 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 41.4 mtt -44.95 -49.89 10.86 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.785 1.234 . . . . 0.0 112.117 -170.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.4 t -66.19 -36.95 84.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.629 -169.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -74.01 -43.18 58.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.498 0.666 . . . . 0.0 109.677 172.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.3 tp -64.64 -46.5 82.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.864 0.866 . . . . 0.0 112.003 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -52.33 -56.55 21.27 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.961 -173.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.06 -36.51 89.07 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 CA-C-N 121.247 1.481 . . . . 0.0 111.824 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.407 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.4 mp -61.21 -52.08 66.29 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -63.14 -38.9 93.0 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.349 0.66 . . . . 0.0 111.341 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -58.74 -51.94 67.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -64.08 -40.05 95.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.282 -0.261 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.401 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 54.4 t90 -53.78 -46.72 71.11 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 172.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.64 -46.23 80.03 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.89 -51.81 59.82 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.016 0.526 . . . . 0.0 110.906 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -58.73 -50.95 72.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.359 0.664 . . . . 0.0 111.099 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 124.022 0.929 . . . . 0.0 111.382 -178.408 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -54.49 -36.98 64.74 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.053 -1.029 . . . . 0.0 109.49 168.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -61.96 -50.26 72.83 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.283 0.633 . . . . 0.0 109.741 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -55.69 -43.39 76.38 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 124.358 1.063 . . . . 0.0 109.688 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -55.48 22.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.592 0.757 . . . . 0.0 109.397 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -54.08 -56.23 20.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -50.63 -54.11 25.44 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.184 0.594 . . . . 0.0 110.992 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.74 -50.38 73.7 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.785 -0.572 . . . . 0.0 110.475 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -28.02 68.76 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.73 -0.606 . . . . 0.0 111.384 176.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 90.1 m -70.92 -45.47 64.19 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -55.04 -44.31 74.56 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.728 0.411 . . . . 0.0 110.08 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -55.97 -54.1 48.88 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.99 -0.444 . . . . 0.0 110.741 174.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -55.1 -46.33 75.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.995 -0.441 . . . . 0.0 111.002 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -53.44 -50.68 64.75 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.186 0.448 . . . . 0.0 110.298 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -54.34 -48.01 71.88 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.559 0.618 . . . . 0.0 111.658 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.39 -54.86 20.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.399 0.545 . . . . 0.0 109.724 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -55.52 -43.85 76.09 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.082 0.401 . . . . 0.0 111.148 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.05 -14.25 60.21 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.355 0.662 . . . . 0.0 112.279 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.16 34.88 87.53 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -173.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 . . . . . 0 C--O 1.234 0.269 0 CA-C-O 122.146 0.974 . . . . 0.0 110.182 -176.631 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.327 0.584 . . . . 0.0 109.654 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.7 t -50.39 -49.61 23.44 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.992 171.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.9 -46.33 32.11 Favored Glycine 0 CA--C 1.527 0.809 0 C-N-CA 123.816 0.722 . . . . 0.0 113.75 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.3 -50.89 68.3 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.28 1.04 . . . . 0.0 110.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.424 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.93 -52.42 65.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.158 -178.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -37.96 58.29 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.886 1.274 . . . . 0.0 109.772 169.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -49.72 -59.83 6.98 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 125.612 1.577 . . . . 0.0 111.16 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -62.84 -39.91 95.83 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.517 0.198 . . . . 0.0 111.306 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.0 tp -84.87 -23.91 28.77 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -168.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -148.96 -65.19 0.23 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.398 1.879 . . . . 0.0 110.601 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 177.27 139.95 3.49 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 -169.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.7 62.46 5.54 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 117.521 0.661 . . . . 0.0 112.355 -167.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -92.24 -155.04 0.4 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.44 40.44 20.76 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 120.843 -1.161 . . . . 0.0 113.894 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -75.51 50.48 0.54 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.092 1.357 . . . . 0.0 108.901 169.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 67.29 -42.28 0.43 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.182 1.793 . . . . 0.0 112.023 -167.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -42.26 -70.49 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.955 2.102 . . . . 0.0 113.216 -173.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 p -65.41 -40.46 93.41 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.54 -0.725 . . . . 0.0 110.409 -174.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.1 mm -54.37 -41.31 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.167 0.987 . . . . 0.0 110.712 173.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.5 m -68.62 -48.37 64.25 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.482 -0.761 . . . . 0.0 109.782 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -58.81 -33.65 70.62 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.756 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.18 -52.29 36.12 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 126.216 1.806 . . . . 0.0 110.531 174.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -60.6 -23.8 64.98 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.62 0.768 . . . . 0.0 112.455 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.03 -6.32 55.67 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 0.0 112.463 169.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.77 41.15 32.13 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 127.075 2.15 . . . . 0.0 112.095 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.29 -7.18 24.85 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.8 mt -83.73 50.53 1.82 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.753 1.16 . . . . 0.0 111.176 -175.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 42.62 31.23 0.28 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.897 2.879 . . . . 0.0 116.038 170.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 t80 67.84 -50.81 0.52 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.21 1.804 . . . . 0.0 113.019 -174.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -38.45 -53.46 1.54 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.593 1.957 . . . . 0.0 112.786 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.88 -49.02 19.09 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 mtp -47.78 -47.2 30.81 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.626 1.571 . . . . 0.0 110.699 -174.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.5 t -59.17 -34.37 72.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.688 0.795 . . . . 0.0 113.106 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -85.37 -36.03 21.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.007 0.908 . . . . 0.0 110.124 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -62.93 -38.74 92.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.223 1.009 . . . . 0.0 110.661 -178.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -53.04 -64.08 1.9 Allowed Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.797 176.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -58.46 -39.02 87.37 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.027 1.818 . . . . 0.0 111.679 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -53.18 -52.58 58.35 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.877 0.762 . . . . 0.0 111.182 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.8 mt -69.35 -36.52 76.95 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.706 -0.621 . . . . 0.0 111.99 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -57.56 -49.76 75.33 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.835 0.743 . . . . 0.0 109.045 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -63.74 -42.24 97.91 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.529 0.332 . . . . 0.0 110.137 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.424 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 71.5 t90 -52.84 -47.04 68.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.217 0.462 . . . . 0.0 110.585 170.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -51.12 70.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -47.53 74.33 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.044 0.538 . . . . 0.0 110.335 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -59.13 -52.88 63.8 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.437 0.695 . . . . 0.0 110.575 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.204 0 C-N-CA 123.219 0.607 . . . . 0.0 110.181 177.801 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 119.551 -0.261 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -48.99 -47.71 44.04 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.387 1.075 . . . . 0.0 110.855 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -57.53 -45.86 84.53 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.349 0.26 . . . . 0.0 110.988 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.53 -53.12 61.31 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 124.573 1.149 . . . . 0.0 110.832 -175.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -57.66 11.83 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.216 0.462 . . . . 0.0 110.581 -177.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -54.93 -49.48 71.22 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -55.44 -50.61 69.37 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.341 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.72 -51.9 64.16 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.348 0.976 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp -59.77 -38.38 81.69 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.0 m -64.9 -44.7 88.72 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 121.706 -0.622 . . . . 0.0 109.78 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.52 -48.76 68.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.736 1.214 . . . . 0.0 109.544 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.95 -45.49 92.46 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 174.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.11 -45.35 83.5 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.013 -1.054 . . . . 0.0 111.247 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -60.95 -44.58 97.07 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 121.547 -0.721 . . . . 0.0 110.576 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -50.09 -48.97 52.95 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.657 0.783 . . . . 0.0 110.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -61.25 -51.26 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 122.951 0.5 . . . . 0.0 110.047 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -56.44 -41.39 76.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.892 0.769 . . . . 0.0 112.228 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.88 -12.06 61.19 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.698 0.799 . . . . 0.0 111.752 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.79 33.39 87.12 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -173.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 CA--C 1.519 -0.245 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.829 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t0 . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 120.425 0.155 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -58.43 -52.22 61.92 Favored 'Isoleucine or valine' 0 C--N 1.342 0.244 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 172.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.96 -50.54 15.19 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 123.454 0.549 . . . . 0.0 111.885 174.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.7 tp -59.51 -57.57 12.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 117.723 0.762 . . . . 0.0 111.107 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.35 97.29 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.103 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.413 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 66.9 mmm -55.34 -44.1 75.6 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.762 -0.586 . . . . 0.0 110.052 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.76 -57.83 5.1 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 124.728 1.156 . . . . 0.0 111.299 169.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -57.44 -50.17 73.88 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 35.2 mt -83.37 -25.61 31.23 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -169.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -145.88 -61.37 0.33 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.55 1.14 . . . . 0.0 111.046 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 166.11 137.48 2.22 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 107.641 -2.184 . . . . 0.0 107.641 -169.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.07 36.44 0.23 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -167.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -83.33 38.51 0.61 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.096 -1.003 . . . . 0.0 111.414 -172.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -152.75 42.79 0.63 Allowed 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 124.377 1.071 . . . . 0.0 109.671 -169.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 p -56.2 -62.05 1.97 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 170.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -154.43 -47.64 0.09 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.474 1.11 . . . . 0.0 111.106 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -47.66 -67.07 0.31 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.969 1.308 . . . . 0.0 114.295 -169.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 12.5 p -56.79 -49.43 75.35 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.047 0.939 . . . . 0.0 110.341 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.4 mm -53.89 -47.74 63.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.753 1.221 . . . . 0.0 110.909 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.9 m -60.02 -48.17 82.81 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.226 -0.921 . . . . 0.0 110.121 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -59.11 -31.15 68.66 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.165 0.586 . . . . 0.0 111.298 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.62 -57.62 7.7 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 124.092 0.957 . . . . 0.0 110.051 174.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.33 -26.45 68.77 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.87 -6.92 59.24 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.665 0.666 . . . . 0.0 112.428 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.9 mp 48.03 49.39 17.26 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.706 2.003 . . . . 0.0 113.082 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.0 -32.1 27.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.657 0.783 . . . . 0.0 110.678 174.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 42.0 mt -81.18 46.17 0.9 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.825 0.85 . . . . 0.0 112.511 -168.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 m -21.93 85.35 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 129.28 3.032 . . . . 0.0 116.568 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.3 t80 69.25 -57.37 0.53 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.352 2.261 . . . . 0.0 114.025 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -46.09 -51.54 13.67 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.465 1.506 . . . . 0.0 112.519 -172.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -46.47 30.27 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtt -46.95 -44.37 19.93 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.944 1.298 . . . . 0.0 111.715 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.3 t -60.72 -29.82 69.59 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -84.49 -47.49 10.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.273 1.035 . . . . 0.0 109.245 172.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.1 -40.58 70.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.164 1.786 . . . . 0.0 111.764 -175.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -60.58 -66.9 1.25 Allowed Pre-proline 0 CA--C 1.536 0.414 0 CA-C-O 117.995 -1.003 . . . . 0.0 111.039 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.61 -40.14 80.35 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.193 1.929 . . . . 0.0 111.726 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.04 -57.02 11.79 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.255 0.622 . . . . 0.0 111.299 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.1 mt -69.53 -35.0 75.05 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -58.71 -49.81 76.22 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.996 0.816 . . . . 0.0 110.131 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -44.94 90.65 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.413 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 76.7 t90 -50.96 -48.82 60.92 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.165 -0.335 . . . . 0.0 110.843 172.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.19 -51.86 67.23 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.78 -46.01 74.36 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.768 0.427 . . . . 0.0 110.316 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.66 -53.08 61.82 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.113 0.565 . . . . 0.0 110.489 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.261 0 C-N-CA 123.227 0.611 . . . . 0.0 110.204 178.316 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp . . . . . 0 CA--C 1.533 0.314 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -45.46 -47.59 13.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.004 0.922 . . . . 0.0 111.255 174.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.41 -47.31 84.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -52.22 60.66 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.222 1.009 . . . . 0.0 111.572 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -53.35 57.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.511 1.051 . . . . 0.0 110.974 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -59.88 -40.88 90.21 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.881 -0.512 . . . . 0.0 110.93 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -54.4 -51.17 65.7 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 121.717 -0.614 . . . . 0.0 109.98 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.64 -46.89 77.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.728 0.694 . . . . 0.0 111.821 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.2 -40.91 82.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.311 0.576 . . . . 0.0 111.036 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.7 m -63.28 -43.85 96.73 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.49 -0.756 . . . . 0.0 109.668 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -60.94 -45.22 95.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.551 1.141 . . . . 0.0 110.174 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -49.14 -52.16 27.94 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.143 0.429 . . . . 0.0 110.262 170.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -59.83 -50.87 72.11 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.797 -0.564 . . . . 0.0 111.257 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -55.85 -48.83 74.82 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.559 0.618 . . . . 0.0 110.59 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.3 ttp85 -52.84 -47.61 67.62 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 110.61 176.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 67.2 mt -60.11 -46.58 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.116 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -58.2 -40.88 82.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.191 0.905 . . . . 0.0 111.276 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.23 -13.1 59.79 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.933 -0.479 . . . . 0.0 112.112 173.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.87 27.74 73.59 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -174.545 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 CA--C 1.535 0.399 0 CA-C-O 120.273 0.082 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.1 t -57.7 -45.34 86.75 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.96 -51.18 25.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 123.686 0.66 . . . . 0.0 112.226 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.54 -50.96 65.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.97 0.908 . . . . 0.0 110.85 -178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.63 79.06 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.534 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 66.3 mmm -55.13 -47.41 75.09 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.075 0.95 . . . . 0.0 110.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.57 -53.29 3.61 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.212 1.387 . . . . 0.0 111.472 170.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -66.08 -55.05 18.46 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -75.29 -34.58 61.32 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -168.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -133.32 -56.59 0.91 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.422 1.089 . . . . 0.0 110.864 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.67 152.54 6.93 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 107.609 -2.197 . . . . 0.0 107.609 -170.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.05 65.77 5.32 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.169 0.985 . . . . 0.0 111.71 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -92.04 177.91 6.03 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.99 -1.855 . . . . 0.0 105.99 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 70.81 21.35 5.18 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.041 0.937 . . . . 0.0 112.882 168.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.3 m -75.01 73.06 2.19 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 169.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 72.41 -69.62 0.18 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 126.517 1.927 . . . . 0.0 112.312 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -46.4 -60.41 2.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.834 1.254 . . . . 0.0 112.159 -168.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.5 m -60.5 -31.55 70.58 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.605 0.762 . . . . 0.0 112.595 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -73.89 -40.8 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 119.013 0.824 . . . . 0.0 109.626 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.0 t -58.94 -53.59 56.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 171.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -58.29 -42.64 87.04 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.486 0.715 . . . . 0.0 111.261 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.1 -62.36 1.68 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 124.294 1.038 . . . . 0.0 109.95 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -62.7 -35.89 81.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.507 -174.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.63 -8.68 44.29 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.43 40.08 27.6 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.998 1.319 . . . . 0.0 110.559 -173.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -79.8 -32.79 40.79 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.574 0.75 . . . . 0.0 110.361 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 mt -81.24 45.19 0.83 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.556 0.742 . . . . 0.0 110.828 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.6 m -15.54 77.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 130.311 3.444 . . . . 0.0 116.763 -169.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.0 t80 69.22 -57.11 0.53 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.501 1.92 . . . . 0.0 114.249 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -39.04 -55.61 1.55 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.712 2.005 . . . . 0.0 113.363 -174.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -73.85 -52.67 12.24 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 122.07 0.938 . . . . 0.0 108.601 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.8 mtp -48.37 -38.57 19.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.537 1.535 . . . . 0.0 113.593 -170.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.78 -30.39 71.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -83.14 -42.28 17.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.607 0.718 . . . . 0.0 109.459 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.262 0.1 OUTLIER -62.86 -37.94 88.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.608 0.763 . . . . 0.0 112.407 -172.735 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -54.6 -67.21 0.7 Allowed Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.959 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.45 -41.58 74.65 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.328 2.019 . . . . 0.0 111.421 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.468 ' C ' HD23 ' A' ' 66' ' ' LEU . 2.4 tt -50.26 -49.86 51.92 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.935 0.494 . . . . 0.0 111.274 171.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 67' ' ' LEU . 11.7 mt -67.65 -42.66 81.9 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 118.953 0.797 . . . . 0.0 111.77 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -55.52 -48.55 74.48 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -62.9 -44.78 95.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.762 0.425 . . . . 0.0 110.843 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -52.53 -49.41 64.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.429 0.559 . . . . 0.0 110.264 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.4 -47.78 77.88 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.986 0.914 . . . . 0.0 109.012 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -50.86 -56.75 10.77 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.134 0.492 . . . . 0.0 110.547 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -60.4 -42.96 97.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.52 0.728 . . . . 0.0 110.217 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.415 0 C-N-CA 124.133 0.973 . . . . 0.0 111.187 174.836 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -57.06 -57.08 14.14 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.66 -38.81 92.52 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 119.717 -0.182 . . . . 0.0 111.297 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.8 mt -58.48 -44.79 89.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.073 173.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.88 -52.18 64.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.197 0.908 . . . . 0.0 108.932 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.46 -53.89 48.15 Favored 'General case' 0 CA--C 1.529 0.135 0 O-C-N 122.146 -0.346 . . . . 0.0 110.147 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -52.08 -49.13 64.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.945 1.298 . . . . 0.0 110.351 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.53 -51.87 68.05 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.309 0.644 . . . . 0.0 111.173 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -57.21 -45.77 83.53 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.721 0.772 . . . . 0.0 110.005 175.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 m -61.01 -31.51 71.13 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.73 -0.606 . . . . 0.0 110.164 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -62.24 -28.96 70.06 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.308 -0.87 . . . . 0.0 110.987 175.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -65.48 -50.54 64.97 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 121.406 -0.809 . . . . 0.0 110.016 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -58.65 -40.88 84.73 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.954 -0.466 . . . . 0.0 110.496 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.4 mtm180 -67.28 -43.49 81.65 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.401 0.68 . . . . 0.0 110.862 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 42.9 mtm180 -49.27 -55.56 12.27 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.08 0.855 . . . . 0.0 109.895 169.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.72 -50.77 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -54.54 -44.6 73.0 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.249 0.62 . . . . 0.0 111.48 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.0 -9.19 58.03 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.04 29.29 74.37 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.067 0.849 . . . . 0.0 111.124 -171.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 N--CA 1.455 -0.188 0 C-N-CA 124.591 1.156 . . . . 0.0 109.821 176.244 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 44.9 t0 . . . . . 0 CA--C 1.531 0.212 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.08 -48.47 78.92 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 171.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.67 -54.59 8.87 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.781 0.705 . . . . 0.0 111.423 173.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 tp -60.4 -54.85 40.69 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.645 0.778 . . . . 0.0 111.054 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.13 -47.14 84.21 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.758 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -43.6 83.79 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.84 -0.537 . . . . 0.0 109.962 173.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.93 -55.7 6.22 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.827 1.203 . . . . 0.0 111.35 169.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.26 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.8 mt -85.66 -25.02 26.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -169.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -143.88 -64.52 0.37 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.117 1.367 . . . . 0.0 110.72 -174.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.97 143.06 3.71 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -171.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.18 71.95 8.18 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -172.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -107.48 26.91 9.67 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.528 0.731 . . . . 0.0 111.865 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -142.75 21.95 1.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -169.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 59.2 m -68.85 84.88 0.32 Allowed 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 169.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.282 4.2 pm0 58.25 -62.89 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 129.507 3.123 . . . . 0.0 113.806 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.3 m -33.46 -70.72 0.07 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.092 2.557 . . . . 0.0 112.953 -175.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 m -59.27 -38.76 80.89 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.091 1.357 . . . . 0.0 112.408 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.38 -35.51 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 122.977 0.511 . . . . 0.0 110.086 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -65.94 -50.41 64.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -56.25 -36.9 69.07 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.745 0.818 . . . . 0.0 111.278 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -60.36 -59.53 5.25 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.865 0.866 . . . . 0.0 110.054 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -56.42 -41.17 75.93 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.499 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.36 -3.45 24.06 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . 0.289 0.6 OUTLIER 40.56 51.82 2.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 127.236 2.214 . . . . 0.0 113.175 -170.828 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -79.39 -43.79 22.73 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.384 1.074 . . . . 0.0 110.838 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -80.22 58.65 3.1 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.699 0.8 . . . . 0.0 110.623 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.1 m -27.56 91.97 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 129.262 3.025 . . . . 0.0 116.121 -171.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 53.2 t80 67.49 -58.68 0.42 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.252 2.221 . . . . 0.0 114.63 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -44.13 -50.55 8.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.571 1.548 . . . . 0.0 112.56 -173.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.4 -54.51 12.13 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.694 0.759 . . . . 0.0 109.287 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.02 -43.41 19.53 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.669 1.588 . . . . 0.0 112.478 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.46 -32.36 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -83.5 -44.02 15.15 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.721 0.772 . . . . 0.0 109.262 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.5 tp -57.42 -42.16 81.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.278 1.031 . . . . 0.0 112.099 -176.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -58.68 -61.51 7.55 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.41 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -58.95 -38.77 86.28 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.721 1.614 . . . . 0.0 111.251 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tt -53.14 -54.13 40.28 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.865 0.757 . . . . 0.0 111.402 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.79 -39.12 87.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.797 0.439 . . . . 0.0 111.333 177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -58.69 -47.35 84.81 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.547 0.612 . . . . 0.0 109.856 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -64.31 -45.69 86.85 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.09 0.556 . . . . 0.0 110.143 177.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -50.95 -48.02 60.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.645 0.26 . . . . 0.0 110.425 173.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -51.41 69.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.422 1.089 . . . . 0.0 109.426 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -45.69 77.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.99 -54.6 35.76 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -178.191 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 C--O 1.227 -0.127 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.77 -39.65 52.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.563 0.745 . . . . 0.0 111.687 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -79.52 -48.08 14.48 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -53.13 -46.99 69.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.462 0.705 . . . . 0.0 111.71 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.09 -60.06 4.15 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.069 0.85 . . . . 0.0 111.658 -176.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -48.29 -52.05 23.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.862 175.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -54.46 -51.23 65.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.034 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.23 -52.71 63.45 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.84 0.746 . . . . 0.0 110.69 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -57.04 -46.41 82.44 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.574 0.702 . . . . 0.0 110.711 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.5 m -60.56 -39.76 89.13 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 123.112 0.565 . . . . 0.0 110.274 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -58.62 -49.15 78.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.934 0.893 . . . . 0.0 109.196 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -56.49 -52.74 63.59 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 122.446 -0.159 . . . . 0.0 110.908 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -52.74 -53.48 47.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.779 0.432 . . . . 0.0 110.666 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -54.63 -54.01 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.77 0.828 . . . . 0.0 110.187 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.0 ptt85 -63.19 -36.8 84.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.987 -0.446 . . . . 0.0 110.985 -174.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 73.8 mt -55.2 -56.03 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 170.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -55.13 -41.31 71.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.131 0.423 . . . . 0.0 111.683 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.6 mt -73.1 -14.7 61.44 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.76 20.61 77.59 Favored Glycine 0 CA--C 1.533 1.157 0 O-C-N 121.343 -0.848 . . . . 0.0 111.368 -170.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 122.481 1.134 . . . . 0.0 109.272 -176.41 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 CA--C 1.53 0.174 0 CA-C-O 120.586 0.232 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 ' CZ2' ' A' ' 70' ' ' TRP . 94.0 t -58.23 -50.37 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -53.76 10.84 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 175.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.18 -52.82 52.62 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.545 0.738 . . . . 0.0 111.018 -174.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -58.82 -47.71 83.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.455 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.57 85.41 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 121.978 -0.451 . . . . 0.0 109.916 173.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.72 -56.55 4.97 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 125.218 1.39 . . . . 0.0 111.131 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -61.88 -51.77 66.83 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 87.5 mt -77.12 -29.11 54.61 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -168.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -143.51 -63.34 0.4 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.491 1.517 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.12 145.75 4.74 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.63 71.08 7.49 Favored 'General case' 0 N--CA 1.461 0.115 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -172.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -107.69 19.96 19.46 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.597 0.759 . . . . 0.0 111.9 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -143.63 33.02 1.28 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -168.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.4 m -72.2 75.05 0.97 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 169.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 68.07 -62.22 0.36 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 127.589 2.356 . . . . 0.0 112.765 172.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -30.33 -77.85 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 128.319 2.648 . . . . 0.0 113.104 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 m -55.62 -38.21 69.2 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.791 0.836 . . . . 0.0 111.938 -174.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -66.74 -44.43 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 m -57.59 -43.71 84.86 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.065 -1.022 . . . . 0.0 109.629 172.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -64.57 -33.06 75.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.184 0.993 . . . . 0.0 111.901 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -63.37 -53.66 49.09 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 109.659 172.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -37.23 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.81 -14.92 63.21 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.057 -0.402 . . . . 0.0 111.827 171.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.0 mt 59.59 42.96 16.51 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.611 1.964 . . . . 0.0 111.604 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -78.5 -31.62 47.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.836 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.78 5.12 0.23 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -169.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.6 m 40.4 58.94 2.19 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.073 1.749 . . . . 0.0 114.549 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.2 t80 68.41 -58.08 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.008 2.123 . . . . 0.0 114.529 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -47.14 -51.45 18.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.864 1.266 . . . . 0.0 112.885 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.2 -43.38 42.69 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.8 mtt -46.82 -45.24 19.98 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 124.54 1.136 . . . . 0.0 111.421 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 t -60.83 -29.31 69.41 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -177.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -83.09 -45.98 13.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.993 0.902 . . . . 0.0 109.387 171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -56.04 -44.28 78.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.932 1.693 . . . . 0.0 111.963 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -60.95 -59.92 12.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.516 -0.755 . . . . 0.0 111.785 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -58.6 -41.21 66.54 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.421 1.414 . . . . 0.0 111.217 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -49.99 -54.35 20.61 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 175.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.7 mt -68.93 -35.31 76.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.773 -0.579 . . . . 0.0 111.565 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -56.66 -50.05 73.23 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.409 0.55 . . . . 0.0 109.597 174.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -60.5 -49.04 79.14 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.921 0.489 . . . . 0.0 110.02 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.408 ' CZ2' HG22 ' A' ' 30' ' ' VAL . 67.6 t90 -49.23 -50.01 40.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.033 0.379 . . . . 0.0 111.009 174.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -48.48 75.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -175.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.32 -42.64 74.01 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 123.075 0.55 . . . . 0.0 111.139 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.52 -51.35 57.59 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.423 0.289 . . . . 0.0 111.116 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 123.735 0.814 . . . . 0.0 112.163 -169.759 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 55.5 mp0 -49.54 -40.12 36.97 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.566 1.546 . . . . 0.0 111.594 175.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.97 -49.98 14.24 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.9 mt -59.25 -44.88 92.36 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.885 0.474 . . . . 0.0 111.593 -172.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -64.86 -56.78 11.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.237 0.542 . . . . 0.0 111.0 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -48.46 -54.55 13.76 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.892 1.277 . . . . 0.0 110.293 172.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -51.45 -53.14 40.11 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.62 -52.1 60.96 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.548 0.339 . . . . 0.0 110.654 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -61.5 -28.38 69.26 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.584 -0.697 . . . . 0.0 111.84 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.3 m -69.76 -43.59 71.93 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.017 -1.052 . . . . 0.0 108.968 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.48 -42.04 81.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.553 0.741 . . . . 0.0 109.829 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -55.25 -56.25 22.09 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.027 -0.42 . . . . 0.0 110.113 172.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.71 -45.53 81.79 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.929 -0.482 . . . . 0.0 111.07 -178.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -53.24 -53.75 46.2 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.196 0.598 . . . . 0.0 110.105 174.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.2 mtm105 -53.62 -55.89 21.93 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.445 0.298 . . . . 0.0 110.817 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.1 mm -51.7 -51.68 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.992 0.917 . . . . 0.0 109.111 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.55 -40.5 71.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.392 0.277 . . . . 0.0 111.363 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.6 mt -86.57 -2.32 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.53 25.07 71.33 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 121.092 -1.005 . . . . 0.0 112.6 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -178.33 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -55.5 -45.7 78.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.97 -49.89 28.38 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 123.302 0.477 . . . . 0.0 112.762 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.26 -56.15 23.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.312 0.645 . . . . 0.0 109.925 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.07 -54.58 37.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.945 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 80.1 mmm -54.69 -44.19 73.15 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.714 1.206 . . . . 0.0 110.468 174.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -42.95 -56.09 4.59 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 125.328 1.442 . . . . 0.0 111.566 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.92 -49.85 64.25 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.765 0.283 . . . . 0.0 111.724 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.76 -34.56 64.77 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -134.78 -59.61 0.8 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.472 1.109 . . . . 0.0 110.93 -172.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.47 146.24 4.61 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 -171.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -81.89 69.59 8.61 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 117.646 0.723 . . . . 0.0 111.422 -169.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -106.41 -155.05 0.53 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 165.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 66.43 -82.13 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.975 0.91 . . . . 0.0 110.61 168.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m 45.05 -72.94 0.0 OUTLIER 'General case' 0 C--N 1.339 0.126 0 C-N-CA 130.011 3.324 . . . . 0.0 115.432 172.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -159.14 -50.33 0.06 Allowed 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.9 p -56.37 -72.28 0.08 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.244 1.017 . . . . 0.0 110.735 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.3 m -55.9 -37.55 69.04 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.494 0.718 . . . . 0.0 111.217 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.75 -42.68 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.618 -0.676 . . . . 0.0 111.871 172.127 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.4 m -65.23 -43.26 92.01 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.487 -0.758 . . . . 0.0 110.517 173.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -54.69 -47.4 73.72 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.609 0.64 . . . . 0.0 110.456 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -55.75 -59.18 5.23 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.898 1.279 . . . . 0.0 110.439 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -55.09 -38.17 67.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.1 0.96 . . . . 0.0 112.508 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.03 -8.95 58.85 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.254 1.022 . . . . 0.0 112.625 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 58.05 47.79 14.16 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.273 1.429 . . . . 0.0 110.784 -175.119 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.01 -47.91 15.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.052 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.14 96.57 1.09 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.9 p -68.12 81.55 0.22 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.565 0.746 . . . . 0.0 111.039 -174.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 78.4 t80 75.53 -48.56 0.61 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.97 2.108 . . . . 0.0 113.341 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -35.78 -61.52 0.47 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.504 1.922 . . . . 0.0 112.415 -169.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -79.78 -44.77 20.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.779 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.7 mtp -42.7 -45.52 4.75 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 125.028 1.331 . . . . 0.0 112.094 -174.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.1 t -60.64 -34.07 73.73 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -79.03 -44.47 22.15 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.082 0.944 . . . . 0.0 109.36 174.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -35.1 75.32 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.056 1.342 . . . . 0.0 113.406 -170.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -58.69 -61.62 7.33 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-O 117.769 -1.11 . . . . 0.0 112.395 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -58.74 -40.15 75.53 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.676 1.584 . . . . 0.0 110.982 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -51.66 -52.51 47.47 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.099 0.96 . . . . 0.0 111.387 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.1 mt -71.24 -33.89 70.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.558 -0.714 . . . . 0.0 111.525 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -57.68 -47.23 82.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -59.01 -47.83 83.78 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -51.11 -47.82 61.85 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.913 0.324 . . . . 0.0 110.565 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.49 94.68 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -41.08 81.06 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.878 0.471 . . . . 0.0 110.259 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -68.16 -52.66 32.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.919 0.39 . . . . 0.0 110.442 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.2 0 C-N-CA 124.328 1.051 . . . . 0.0 112.23 -171.326 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -52.09 -42.4 63.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.432 0.693 . . . . 0.0 111.197 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -37.92 62.64 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.846 -0.534 . . . . 0.0 109.82 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.494 HD12 ' C ' ' A' ' 9' ' ' LEU . 0.1 OUTLIER -59.55 -46.36 89.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.445 -0.788 . . . . 0.0 111.476 178.126 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -58.77 -58.49 8.36 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.77 1.168 . . . . 0.0 111.175 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -46.22 -54.41 8.83 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.707 0.803 . . . . 0.0 110.189 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.24 -49.96 65.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.461 1.105 . . . . 0.0 111.087 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.23 -53.77 54.35 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.521 0.6 . . . . 0.0 110.496 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -56.91 -43.04 80.98 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.314 0.578 . . . . 0.0 110.751 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.2 m -60.99 -48.01 83.82 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -54.7 -47.29 73.88 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.379 0.672 . . . . 0.0 110.052 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.44 -47.36 82.01 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.204 0.456 . . . . 0.0 111.276 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.81 -44.78 82.32 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.903 -0.498 . . . . 0.0 111.001 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.4 mmt-85 -59.59 -46.15 89.8 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.607 0.639 . . . . 0.0 110.883 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -54.7 -46.99 74.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.34 0.656 . . . . 0.0 110.596 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt -61.26 -50.15 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.348 0.659 . . . . 0.0 109.812 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -47.44 67.36 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.822 0.849 . . . . 0.0 110.329 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -67.42 -12.97 61.55 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.751 0.82 . . . . 0.0 112.353 178.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.33 33.87 86.25 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.999 0.904 . . . . 0.0 108.972 -175.039 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 120.461 0.172 . . . . 0.0 110.603 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -51.44 -46.48 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 172.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -55.47 -45.81 82.79 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 118.109 0.413 . . . . 0.0 112.517 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.99 -51.64 66.07 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 121.643 0.735 . . . . 0.0 110.41 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.1 85.51 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.752 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -42.23 80.3 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 124.097 0.959 . . . . 0.0 109.841 172.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -56.91 5.71 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 125.358 1.456 . . . . 0.0 111.154 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.65 -51.12 70.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.74 0.27 . . . . 0.0 111.615 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 mt -81.59 -25.21 35.93 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 115.135 1.531 . . . . 0.0 115.135 -168.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -143.31 -63.11 0.4 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.772 1.229 . . . . 0.0 111.133 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.27 145.28 5.18 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.79 56.5 3.08 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 117.839 0.82 . . . . 0.0 112.51 -167.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -88.6 -175.74 5.04 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 168.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 68.51 40.41 1.94 Allowed 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.972 -1.08 . . . . 0.0 112.634 169.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.3 p -74.96 52.5 0.55 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.965 1.306 . . . . 0.0 109.906 171.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 64.88 -44.86 0.33 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.541 1.936 . . . . 0.0 113.532 -169.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.1 p -44.12 -68.48 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.529 1.932 . . . . 0.0 111.864 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -35.54 73.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.843 0.857 . . . . 0.0 111.323 -174.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.0 mm -64.41 -46.67 92.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.257 0.623 . . . . 0.0 109.507 174.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.1 m -56.52 -45.6 81.0 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.983 -1.073 . . . . 0.0 110.22 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -57.04 -41.48 78.74 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.064 -0.397 . . . . 0.0 111.572 174.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -58.26 -52.61 64.86 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 122.973 0.509 . . . . 0.0 110.298 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.33 -27.47 69.05 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.8 -8.19 56.85 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.573 0.624 . . . . 0.0 111.87 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.31 42.14 25.38 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.987 1.715 . . . . 0.0 110.352 -171.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -79.77 -38.14 33.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.653 -173.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 mt -80.45 56.12 2.47 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.948 0.899 . . . . 0.0 112.873 -169.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.2 m 21.7 53.57 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 130.861 3.664 . . . . 0.0 116.94 169.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.1 t80 65.25 -57.32 0.3 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.321 2.249 . . . . 0.0 114.016 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -38.95 -53.09 1.77 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.447 1.899 . . . . 0.0 113.235 -175.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -72.7 -58.02 3.67 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.501 0.667 . . . . 0.0 109.217 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.3 mtp -44.1 -44.79 7.78 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.724 2.01 . . . . 0.0 112.256 -173.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.33 -31.62 72.9 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.811 0.845 . . . . 0.0 112.613 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -82.16 -37.83 25.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 171.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.071 0.948 . . . . 0.0 110.983 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -51.25 -68.32 0.4 Allowed Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.645 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.33 -37.63 94.22 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.862 1.708 . . . . 0.0 111.524 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -53.63 -54.06 43.01 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.678 0.672 . . . . 0.0 111.293 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 57.0 mt -67.65 -37.96 83.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 121.851 -0.531 . . . . 0.0 111.241 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -57.09 -49.97 74.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.349 0.522 . . . . 0.0 109.856 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -66.43 -42.61 87.43 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 122.246 -0.284 . . . . 0.0 110.482 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -50.59 -49.45 56.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.965 0.348 . . . . 0.0 110.173 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.24 -50.68 69.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -178.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -39.71 61.89 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.637 0.775 . . . . 0.0 111.15 178.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -71.82 -52.41 17.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 117.859 0.3 . . . . 0.0 110.82 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.151 0.98 . . . . 0.0 112.354 -170.86 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp . . . . . 0 CA--C 1.533 0.29 0 N-CA-C 110.709 -0.108 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -49.87 -44.78 50.04 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.328 1.451 . . . . 0.0 111.776 174.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.01 -51.58 37.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.0 mt -53.4 -48.83 68.32 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.787 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -59.27 -61.65 2.47 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.066 0.848 . . . . 0.0 111.247 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -50.62 -52.69 37.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.725 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.52 -50.45 65.42 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.131 0.572 . . . . 0.0 111.1 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -53.1 61.77 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.393 0.677 . . . . 0.0 110.899 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -55.11 -47.02 75.58 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.319 0.58 . . . . 0.0 109.804 177.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.8 m -62.72 -39.09 92.96 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 123.238 0.615 . . . . 0.0 110.579 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -60.02 -51.39 69.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.208 1.003 . . . . 0.0 108.885 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -56.7 -53.69 54.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.398 0.279 . . . . 0.0 110.814 175.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.45 -52.64 53.06 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.662 -0.649 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -62.55 -48.06 81.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.371 0.668 . . . . 0.0 110.761 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 -57.64 -44.15 85.4 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.67 0.668 . . . . 0.0 109.451 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 84.9 mt -59.19 -47.76 89.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 O-C-N 122.081 -0.387 . . . . 0.0 110.003 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -56.36 -40.24 74.19 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.65 0.659 . . . . 0.0 111.503 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.2 mt -72.68 -1.39 16.12 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.48 25.49 74.11 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 121.236 -0.915 . . . . 0.0 111.664 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 . . . . . 0 N--CA 1.452 -0.335 0 C-N-CA 123.871 0.868 . . . . 0.0 108.879 -178.701 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 t70 . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.7 t -58.09 -56.05 18.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.68 -49.05 12.53 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-N 118.095 0.407 . . . . 0.0 112.25 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.88 -52.56 65.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.709 1.204 . . . . 0.0 110.049 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.59 -47.72 78.94 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.844 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 48.3 mmm -56.15 -46.31 79.31 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 121.695 -0.628 . . . . 0.0 109.637 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -41.49 -56.65 3.45 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 125.546 1.545 . . . . 0.0 111.662 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -65.36 -50.41 65.65 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.361 0.665 . . . . 0.0 111.801 -178.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.89 -48.18 66.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.163 0.438 . . . . 0.0 111.959 -174.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 4.3 m-85 -126.41 -56.09 1.42 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.246 1.019 . . . . 0.0 111.154 -169.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.28 152.53 6.29 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 107.934 -2.066 . . . . 0.0 107.934 -169.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -81.02 54.35 2.19 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.887 -0.773 . . . . 0.0 111.076 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.69 -15.1 61.24 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.885 -0.51 . . . . 0.0 111.501 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.78 43.8 1.74 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.104 1.762 . . . . 0.0 107.725 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.6 p -61.65 -62.8 1.55 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.838 0.855 . . . . 0.0 110.349 -169.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.48 -55.31 0.05 OUTLIER 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.199 0.599 . . . . 0.0 112.226 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -52.93 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.407 1.083 . . . . 0.0 109.423 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 p -55.03 -51.53 66.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.184 0.994 . . . . 0.0 111.67 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -59.39 -46.98 92.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 O-C-N 122.02 -0.425 . . . . 0.0 110.71 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.0 m -56.43 -50.5 71.47 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.938 0.875 . . . . 0.0 110.77 175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -62.03 -30.1 70.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.765 1.226 . . . . 0.0 111.454 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -61.23 -57.4 12.56 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.176 0.591 . . . . 0.0 109.796 173.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.07 -30.52 68.13 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.61 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.34 -7.45 59.07 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.05 36.95 13.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.14 1.776 . . . . 0.0 112.106 -171.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -80.19 -31.57 38.74 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.844 -0.535 . . . . 0.0 111.861 -175.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -79.11 53.53 1.46 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.718 0.807 . . . . 0.0 111.554 -175.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.7 m -5.23 71.57 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 130.407 3.483 . . . . 0.0 116.49 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.7 t80 66.64 -57.81 0.39 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.938 2.095 . . . . 0.0 114.262 174.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.8 -55.56 3.6 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.517 1.527 . . . . 0.0 113.734 -169.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.18 -46.92 39.05 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 57.4 mtp -50.82 -42.11 58.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.342 1.457 . . . . 0.0 111.273 -173.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.4 t -64.36 -28.42 69.69 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.782 0.833 . . . . 0.0 112.663 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -82.7 -45.06 14.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.863 0.839 . . . . 0.0 109.425 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.267 0.1 OUTLIER -59.84 -46.92 87.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.819 1.247 . . . . 0.0 112.609 -178.249 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -55.12 -58.3 15.55 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -59.73 -34.81 95.96 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.848 1.698 . . . . 0.0 111.488 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.9 mp -63.69 -45.35 90.45 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 19.1 mt -62.9 -39.63 95.11 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 173.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.64 -50.37 74.1 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.899 0.772 . . . . 0.0 109.361 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.65 -47.8 81.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.358 0.663 . . . . 0.0 110.27 175.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -53.02 -43.45 66.56 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 122.228 -0.295 . . . . 0.0 110.487 174.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.88 -46.78 80.32 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -39.64 73.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.028 0.531 . . . . 0.0 110.611 176.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.52 -58.1 4.06 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.94 0.496 . . . . 0.0 111.537 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.151 0 C-N-CA 124.601 1.16 . . . . 0.0 112.158 -169.896 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 C--O 1.226 -0.155 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.4 mp0 -49.84 -45.43 50.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.198 1.399 . . . . 0.0 111.05 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.21 -48.36 57.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -55.79 -54.04 49.26 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.414 0.686 . . . . 0.0 111.444 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.04 -56.59 20.24 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-N 119.027 0.831 . . . . 0.0 111.137 -177.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.38 -54.88 18.5 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -54.21 -48.96 70.45 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.904 0.482 . . . . 0.0 110.744 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -52.37 65.81 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.142 0.977 . . . . 0.0 111.066 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -59.42 -46.97 87.21 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.627 -0.67 . . . . 0.0 110.122 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.8 m -60.71 -38.42 84.99 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 122.022 -0.423 . . . . 0.0 110.129 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.39 -46.28 90.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.847 0.859 . . . . 0.0 109.171 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -56.21 -50.67 70.6 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.266 0.484 . . . . 0.0 110.444 174.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -56.86 -48.5 77.97 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.162 -0.961 . . . . 0.0 110.885 178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -57.55 -42.37 82.84 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.934 -0.479 . . . . 0.0 111.061 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -54.64 -49.08 71.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.489 1.115 . . . . 0.0 110.349 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.2 mm -61.71 -48.82 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.233 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.95 -44.43 87.0 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.259 0.481 . . . . 0.0 111.389 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.2 mt -64.43 -37.98 89.44 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.255 0.622 . . . . 0.0 110.35 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.55 34.36 6.08 Favored Glycine 0 CA--C 1.525 0.719 0 C-N-CA 124.369 0.985 . . . . 0.0 111.348 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 122.938 1.351 . . . . 0.0 108.258 173.043 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.1 t70 . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.0 t -42.42 -43.46 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 124.28 1.032 . . . . 0.0 109.259 167.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.42 -45.63 16.68 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.125 0.869 . . . . 0.0 113.566 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.6 tp -70.07 -52.79 21.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.725 0.774 . . . . 0.0 109.87 -176.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.97 80.99 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.386 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.7 mmm -53.92 -47.3 71.33 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 110.318 170.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.48 -54.2 3.38 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 125.308 1.432 . . . . 0.0 111.461 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.62 -53.14 37.41 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 mt -76.15 -31.94 58.83 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -168.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -135.63 -56.69 0.79 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.461 1.105 . . . . 0.0 110.52 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.83 156.17 8.63 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -170.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.66 74.12 5.2 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.839 0.82 . . . . 0.0 110.489 -169.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -109.38 159.91 16.61 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 73.74 33.88 0.98 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.509 1.123 . . . . 0.0 113.771 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.4 m -75.05 65.29 1.45 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 54.0 tp60 64.05 -59.15 0.2 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.163 2.185 . . . . 0.0 112.5 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.1 p -32.19 -66.28 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.002 1.721 . . . . 0.0 113.081 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.17 -30.93 71.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.922 0.889 . . . . 0.0 112.383 -177.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 26.0 mm -67.15 -49.06 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.2 m -52.45 -53.61 43.18 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.579 -0.701 . . . . 0.0 110.373 173.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -59.36 -37.81 78.82 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.616 0.766 . . . . 0.0 111.364 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 63' ' ' LEU . 7.8 t80 -61.37 -60.3 3.93 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.268 0.627 . . . . 0.0 110.039 177.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.26 -41.59 76.05 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.12 -11.98 58.7 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 55.39 46.59 23.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.303 1.441 . . . . 0.0 110.911 -173.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -79.92 -41.12 26.73 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.439 1.095 . . . . 0.0 110.929 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.3 mt -77.91 -162.23 0.31 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.3 m -154.73 173.29 16.62 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 120.772 -1.205 . . . . 0.0 109.104 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -41.53 0.86 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.07 2.548 . . . . 0.0 112.07 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -39.61 -39.48 0.75 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.131 1.372 . . . . 0.0 112.023 176.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -104.75 -56.02 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.685 1.594 . . . . 0.0 109.743 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.0 mtt -47.15 -39.52 13.8 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.128 1.771 . . . . 0.0 113.945 -170.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.0 t -66.42 -25.31 66.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -90.03 -40.28 12.41 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.0 OUTLIER -55.93 -43.23 77.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.332 0.653 . . . . 0.0 111.814 -178.438 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -54.02 -65.77 1.12 Allowed Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 118.978 -0.534 . . . . 0.0 112.216 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -58.78 -40.75 69.69 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.891 1.728 . . . . 0.0 111.655 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 tt -49.19 -51.99 29.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 111.172 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.55 -40.21 80.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 121.775 -0.578 . . . . 0.0 111.275 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -61.68 -44.7 96.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.453 1.024 . . . . 0.0 110.259 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -61.65 -46.67 88.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.716 -0.615 . . . . 0.0 109.812 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -50.79 -46.58 59.7 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.791 0.269 . . . . 0.0 110.32 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.75 -48.85 79.93 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.761 0.824 . . . . 0.0 109.239 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -57.25 -48.82 77.88 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -57.6 -48.57 79.03 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.15 0.58 . . . . 0.0 109.64 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 C-N-CA 124.61 1.164 . . . . 0.0 110.993 176.59 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.484 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -45.67 -47.53 15.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.241 1.416 . . . . 0.0 112.003 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -74.32 -49.66 21.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.73 -48.99 71.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.366 0.667 . . . . 0.0 111.496 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -61.19 -61.13 2.78 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.615 0.643 . . . . 0.0 110.843 -178.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -51.38 -48.28 62.61 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.413 0.685 . . . . 0.0 110.509 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -54.72 -51.83 64.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.763 0.425 . . . . 0.0 110.48 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.38 -52.83 58.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.35 0.523 . . . . 0.0 111.274 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -54.5 -46.45 73.47 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.896 0.379 . . . . 0.0 110.017 177.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.0 m -59.75 -42.54 93.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.821 0.449 . . . . 0.0 110.383 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -60.64 -44.87 95.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.844 0.458 . . . . 0.0 109.917 177.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -59.3 -48.92 79.81 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.724 -0.61 . . . . 0.0 111.079 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -55.45 -50.26 70.31 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.249 0.62 . . . . 0.0 110.141 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -52.01 -55.63 19.31 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.373 173.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -53.19 -49.27 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 110.439 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.1 mt -60.39 -44.94 97.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.539 0.736 . . . . 0.0 110.128 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -57.92 -41.37 82.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.749 0.704 . . . . 0.0 111.075 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.09 -10.81 59.95 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 173.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.15 73.88 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 123.623 0.769 . . . . 0.0 109.901 -176.692 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 CA--C 1.531 0.227 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.2 t -55.66 -41.02 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.9 -52.77 24.81 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.097 0.856 . . . . 0.0 112.993 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 tp -72.32 -47.52 49.1 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 117.997 0.898 . . . . 0.0 110.639 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.63 -51.71 64.55 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.288 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 62.4 mtp -64.56 -37.6 88.11 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 121.895 -0.503 . . . . 0.0 110.699 170.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -37.83 -56.75 1.68 Allowed Glycine 0 C--O 1.229 -0.206 0 C-N-CA 126.083 1.801 . . . . 0.0 111.262 172.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -76.1 -45.94 31.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.6 tp -72.02 -16.49 62.06 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -170.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -153.81 -64.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.856 1.662 . . . . 0.0 111.097 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.94 149.08 6.03 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 -169.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.93 67.77 8.05 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 117.746 0.773 . . . . 0.0 111.137 -168.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -121.76 170.73 9.46 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.501 1.52 . . . . 0.0 107.53 171.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.428 ' HB3' HG12 ' A' ' 47' ' ' ILE . 79.3 m-85 62.26 45.06 7.07 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.305 1.042 . . . . 0.0 111.44 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -62.53 -59.09 5.44 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.2 1.0 . . . . 0.0 109.072 169.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.59 -51.38 0.06 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.64 1.576 . . . . 0.0 108.849 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.9 p -50.63 -58.67 5.3 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.353 1.061 . . . . 0.0 111.742 -175.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.38 78.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.7 1.2 . . . . 0.0 111.1 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.428 HG12 ' HB3' ' A' ' 42' ' ' PHE . 7.8 mm -63.82 -56.54 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.799 0.84 . . . . 0.0 109.239 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.9 m -50.33 -45.38 54.82 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.215 -0.928 . . . . 0.0 111.275 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -60.8 -37.48 82.09 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.416 ' CD2' HD11 ' A' ' 63' ' ' LEU . 6.2 t80 -59.0 -55.49 34.46 Favored 'General case' 0 CA--C 1.522 -0.114 0 CA-C-N 118.71 0.687 . . . . 0.0 109.699 172.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.04 -31.46 70.0 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.8 -2.57 40.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.177 0.591 . . . . 0.0 112.421 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mp 53.52 35.75 21.59 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.88 1.672 . . . . 0.0 112.252 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -31.53 50.83 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.99 39.68 0.51 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.961 0.904 . . . . 0.0 109.937 176.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.8 m -37.83 94.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 128.864 2.866 . . . . 0.0 115.567 -167.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.9 t80 69.2 -56.89 0.54 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 128.197 2.599 . . . . 0.0 113.63 173.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -39.72 -51.6 2.33 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.535 1.934 . . . . 0.0 112.83 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -47.53 14.98 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.7 mtt -44.24 -40.09 4.91 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.458 1.903 . . . . 0.0 112.847 -169.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 24.2 t -65.07 -25.97 68.04 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 118.473 -1.291 . . . . 0.0 112.912 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -90.17 -45.16 9.28 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 169.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -56.95 -42.28 79.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 125.143 1.377 . . . . 0.0 112.476 -174.256 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.6 -62.0 6.83 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.362 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.96 -38.35 92.5 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.342 1.361 . . . . 0.0 111.735 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.31 -55.49 27.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.642 0.777 . . . . 0.0 111.449 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.38 -37.45 83.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 121.074 -1.016 . . . . 0.0 111.254 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -58.5 -47.85 82.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.594 -0.691 . . . . 0.0 109.276 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -61.55 -44.05 97.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.359 0.663 . . . . 0.0 110.085 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.7 t90 -52.49 -49.29 65.02 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.769 0.713 . . . . 0.0 110.563 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.25 -48.55 77.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.549 0.74 . . . . 0.0 109.427 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -56.55 -45.13 81.4 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 122.687 0.395 . . . . 0.0 110.654 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.67 -47.55 85.74 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.978 0.511 . . . . 0.0 110.86 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.264 0 C-N-CA 123.466 0.706 . . . . 0.0 110.998 -179.743 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt . . . . . 0 CA--C 1.53 0.206 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -50.3 -37.17 35.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.572 1.149 . . . . 0.0 111.875 173.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -83.86 -45.01 13.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.986 0.514 . . . . 0.0 110.381 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.15 -46.87 62.16 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.657 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -57.76 -63.53 1.21 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.133 0.879 . . . . 0.0 111.511 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -55.7 -46.01 77.76 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.551 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.06 -52.41 64.37 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.98 0.512 . . . . 0.0 110.093 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.27 74.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.886 -0.509 . . . . 0.0 109.946 -177.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -56.19 -33.98 65.8 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.969 -0.457 . . . . 0.0 111.569 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.3 m -69.52 -40.43 76.93 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 121.469 -0.769 . . . . 0.0 109.449 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.27 -41.57 84.58 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -57.81 -51.6 68.93 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.97 -0.456 . . . . 0.0 110.814 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -55.57 -48.16 75.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.102 0.561 . . . . 0.0 110.417 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.67 -46.77 86.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.335 0.654 . . . . 0.0 110.771 176.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 mtm105 -55.15 -50.22 69.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.813 -0.554 . . . . 0.0 110.99 174.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.9 mt -54.71 -51.25 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -54.51 -45.36 73.28 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 122.678 0.391 . . . . 0.0 111.358 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 mt -74.16 -17.74 60.87 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.658 0.783 . . . . 0.0 112.368 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.02 32.19 72.99 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.051 0.834 . . . . 0.0 111.07 -170.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 . . . . . 0 N--CA 1.457 -0.117 0 C-N-CA 123.811 0.844 . . . . 0.0 111.088 -173.686 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.3 -48.46 32.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.939 170.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -49.99 17.63 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.275 0.94 . . . . 0.0 112.095 176.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 tp -62.39 -53.35 56.27 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.802 0.841 . . . . 0.0 110.702 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.94 78.12 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.366 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtp -55.39 -43.01 74.8 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 123.768 0.827 . . . . 0.0 110.233 169.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.24 -53.76 6.57 Favored Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.456 1.503 . . . . 0.0 111.73 168.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -62.65 -48.8 77.74 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.409 0.283 . . . . 0.0 111.373 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.65 -48.36 22.44 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 3.8 m-85 -125.12 -62.47 1.22 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.358 1.863 . . . . 0.0 112.952 -168.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.52 138.49 2.73 Favored Glycine 0 CA--C 1.531 1.089 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.52 59.15 4.5 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.506 0.722 . . . . 0.0 111.593 -167.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.57 -20.0 19.34 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -172.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -101.78 78.6 1.83 Allowed 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -166.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.5 t -73.47 171.14 13.7 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 165.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.28 -38.61 42.0 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -54.17 -57.76 9.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.569 1.147 . . . . 0.0 111.854 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -41.49 92.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.62 0.768 . . . . 0.0 110.109 -176.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -59.27 -43.2 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 122.015 -0.428 . . . . 0.0 110.966 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.2 m -59.12 -43.24 91.93 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 118.692 0.678 . . . . 0.0 110.093 174.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -47.87 61.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.611 0.364 . . . . 0.0 110.815 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.564 ' CD1' HD13 ' A' ' 63' ' ' LEU . 27.5 t80 -62.93 -54.93 30.89 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 122.37 0.268 . . . . 0.0 111.624 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.51 -23.24 66.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.096 0.958 . . . . 0.0 113.11 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.26 -7.62 59.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.844 0.858 . . . . 0.0 111.186 169.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp 52.24 44.34 29.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 126.387 1.875 . . . . 0.0 110.019 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -79.52 -33.58 41.9 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.024 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.5 mt -78.35 46.09 0.6 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.878 0.871 . . . . 0.0 112.621 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.3 t 60.77 -76.59 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.067 2.147 . . . . 0.0 113.179 174.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.1 t80 176.28 -47.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 126.554 1.942 . . . . 0.0 107.795 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -54.03 2.73 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.562 1.545 . . . . 0.0 112.995 -176.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -76.24 -56.45 4.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 37.9 mtp -38.33 -49.04 1.39 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.438 2.295 . . . . 0.0 112.178 -178.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.13 -41.7 84.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.0 0.92 . . . . 0.0 112.589 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -77.68 -34.72 52.81 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.3 0.64 . . . . 0.0 109.902 175.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.564 HD13 ' CD1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -53.77 -50.89 65.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.084 1.353 . . . . 0.0 110.511 177.611 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -46.2 -64.14 1.06 Allowed Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.26 -34.82 98.12 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 121.973 1.782 . . . . 0.0 111.837 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.5 mp -61.61 -51.99 66.24 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.57 -39.24 90.46 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.652 0.381 . . . . 0.0 111.283 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.15 -51.86 67.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.941 -0.474 . . . . 0.0 110.182 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.14 -43.5 98.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.7 0.4 . . . . 0.0 110.157 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -52.59 -45.29 66.44 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 172.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.11 -46.56 80.53 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.66 -40.92 66.31 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.985 0.514 . . . . 0.0 110.59 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -70.03 -55.3 9.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.769 0.428 . . . . 0.0 111.543 177.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.192 0 C-N-CA 124.17 0.988 . . . . 0.0 112.766 -169.115 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 CA--C 1.527 0.084 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -37.24 -51.75 1.04 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.116 1.366 . . . . 0.0 111.455 174.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.22 -48.73 78.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.795 0.838 . . . . 0.0 110.05 -178.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.42 -48.32 82.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.431 1.092 . . . . 0.0 110.155 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.09 -58.16 9.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.716 0.769 . . . . 0.0 109.896 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -56.32 -51.51 67.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.511 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -51.53 -52.86 43.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 110.822 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -53.48 44.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.032 0.833 . . . . 0.0 110.708 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -67.25 -12.54 60.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.2 m -90.29 -38.19 13.56 Favored 'General case' 0 C--O 1.228 -0.076 0 C-N-CA 124.129 0.972 . . . . 0.0 109.537 175.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -53.05 -44.83 67.72 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.848 0.859 . . . . 0.0 108.885 173.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -48.58 -56.86 7.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.245 0.618 . . . . 0.0 111.602 169.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -60.4 -49.38 77.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 O-C-N 121.991 -0.443 . . . . 0.0 110.483 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -55.95 -52.09 65.39 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.895 0.316 . . . . 0.0 110.188 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -50.99 -50.56 58.19 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.252 1.021 . . . . 0.0 110.786 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -59.98 -51.43 72.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.085 0.554 . . . . 0.0 110.253 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.23 -40.71 82.44 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.591 0.632 . . . . 0.0 111.532 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.5 mt -67.8 -16.3 64.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.696 0.799 . . . . 0.0 111.449 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.57 29.77 74.3 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -173.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-O 121.932 0.872 . . . . 0.0 109.147 -174.395 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.6 t -59.17 -46.55 92.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.64 -52.6 24.23 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.9 tp -60.08 -54.47 45.6 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 123.518 0.727 . . . . 0.0 110.808 -178.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.85 91.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.127 -176.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.416 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 73.9 mmm -56.83 -45.15 82.51 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.803 -0.561 . . . . 0.0 110.084 171.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.54 -55.72 5.17 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 124.916 1.246 . . . . 0.0 111.224 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 tptp -52.93 -48.85 67.01 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.652 0.781 . . . . 0.0 112.293 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.6 mt -90.01 -35.91 15.24 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -169.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -132.57 -59.26 0.91 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.259 1.423 . . . . 0.0 110.889 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.98 142.69 3.46 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 107.85 -2.1 . . . . 0.0 107.85 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -79.41 38.36 0.36 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.309 1.054 . . . . 0.0 113.314 -168.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.56 39.11 0.59 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.463 -0.773 . . . . 0.0 111.134 -174.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -144.19 31.14 1.25 Allowed 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 125.51 1.524 . . . . 0.0 108.996 -169.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.7 m -76.66 67.25 2.74 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.488 1.115 . . . . 0.0 108.163 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 75.15 -48.0 0.62 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.524 1.929 . . . . 0.0 113.124 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.5 p -49.23 -79.41 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.075 1.35 . . . . 0.0 112.266 -172.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.2 p -54.31 -44.97 72.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.404 1.082 . . . . 0.0 110.525 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.34 -53.62 37.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.716 0.806 . . . . 0.0 111.202 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.8 p -60.35 -48.88 79.85 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.775 -0.578 . . . . 0.0 110.15 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -58.27 -34.95 71.06 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.423 . . . . 0.0 111.984 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -69.43 -53.05 21.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 123.629 0.772 . . . . 0.0 110.307 178.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -55.6 -40.25 71.82 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.832 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.88 -10.79 59.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.359 1.064 . . . . 0.0 112.838 173.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.4 mt 58.74 45.66 15.36 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 127.121 2.168 . . . . 0.0 112.767 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.32 -30.45 30.45 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.844 1.258 . . . . 0.0 111.119 176.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -80.26 47.92 0.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.981 0.912 . . . . 0.0 113.094 -168.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 m -16.99 84.31 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 129.545 3.138 . . . . 0.0 116.82 -171.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.2 t80 66.05 -58.08 0.34 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.714 2.406 . . . . 0.0 114.725 172.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -44.25 -50.54 8.84 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.612 1.565 . . . . 0.0 112.379 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -47.07 21.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.0 mtt -45.6 -46.15 14.17 Favored 'General case' 0 C--O 1.225 -0.237 0 C-N-CA 125.22 1.408 . . . . 0.0 111.636 -174.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.9 t -64.82 -22.78 67.06 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -174.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -90.04 -46.87 8.21 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.369 1.08 . . . . 0.0 108.696 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.23 -38.74 77.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.971 1.708 . . . . 0.0 111.734 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -61.39 -63.04 4.77 Favored Pre-proline 0 N--CA 1.452 -0.327 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.16 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -58.1 -39.94 81.27 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 CA-C-N 120.869 1.346 . . . . 0.0 111.181 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.62 -57.23 11.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.18 0.592 . . . . 0.0 111.433 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.2 mt -69.43 -34.11 73.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -58.38 -49.53 76.91 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.018 0.827 . . . . 0.0 109.08 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -62.29 -43.75 98.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.416 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 67.0 t90 -53.16 -49.53 66.42 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 117.906 0.321 . . . . 0.0 110.978 172.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -50.62 72.5 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -174.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -54.31 -53.01 59.62 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.37 0.668 . . . . 0.0 110.84 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -56.42 -51.87 66.76 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.378 0.671 . . . . 0.0 110.969 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.167 0 C-N-CA 123.312 0.645 . . . . 0.0 110.207 178.823 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -40.15 -42.37 1.45 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.991 1.716 . . . . 0.0 112.467 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -74.59 -48.93 23.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.588 0.755 . . . . 0.0 110.244 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.11 -45.67 90.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.747 0.819 . . . . 0.0 111.088 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -57.43 -60.33 3.81 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.381 0.992 . . . . 0.0 111.04 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -56.91 -46.42 81.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.224 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -54.44 -48.6 71.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.329 0.513 . . . . 0.0 111.042 176.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.8 -51.41 67.19 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.614 1.166 . . . . 0.0 110.465 -176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -57.15 -45.28 83.73 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.502 0.668 . . . . 0.0 109.563 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.1 m -64.26 -32.18 73.67 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.909 -0.494 . . . . 0.0 110.494 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -63.28 -48.07 79.67 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.764 1.166 . . . . 0.0 109.345 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -52.3 -53.01 49.69 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 171.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -59.37 -44.35 92.73 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.649 -0.657 . . . . 0.0 111.81 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -59.12 -48.46 81.52 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.498 0.719 . . . . 0.0 110.312 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 64.9 ttp85 -52.04 -49.38 63.56 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.654 0.782 . . . . 0.0 110.252 175.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.03 -47.4 91.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 122.702 0.401 . . . . 0.0 110.143 178.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -59.26 -41.14 88.09 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.835 0.743 . . . . 0.0 111.604 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.53 -17.66 64.11 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.027 -0.42 . . . . 0.0 111.695 172.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.43 28.46 71.18 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -173.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 N--CA 1.454 -0.274 0 CA-C-N 117.47 0.635 . . . . 0.0 109.793 -176.745 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t0 . . . . . 0 C--O 1.226 -0.151 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.4 t -52.93 -52.84 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.07 175.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.37 -49.38 45.15 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.266 0.46 . . . . 0.0 112.262 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.4 tp -62.4 -53.64 51.92 Favored 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 121.701 0.762 . . . . 0.0 110.872 -177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.97 92.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.745 0.818 . . . . 0.0 110.387 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -44.99 79.52 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.012 0.525 . . . . 0.0 109.747 171.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.08 -58.03 3.93 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.62 1.581 . . . . 0.0 111.352 169.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.8 -52.75 62.92 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.8 mt -75.34 -34.48 61.2 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -134.96 -59.5 0.79 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.087 0.955 . . . . 0.0 111.067 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 170.63 154.72 9.76 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 -171.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.12 68.24 4.11 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 123.604 0.761 . . . . 0.0 110.57 -169.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -112.29 172.69 6.76 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.59 1.956 . . . . 0.0 107.416 173.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 70.73 19.58 5.92 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -72.92 79.51 1.17 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 169.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 64.46 -67.16 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.412 2.285 . . . . 0.0 112.408 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 p -29.09 -75.45 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 127.829 2.452 . . . . 0.0 113.043 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -46.35 74.45 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.769 1.227 . . . . 0.0 111.251 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.6 mm -58.81 -49.92 81.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.484 1.114 . . . . 0.0 109.584 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.9 m -56.35 -54.1 49.47 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.83 -0.544 . . . . 0.0 110.226 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -71.05 -22.0 62.18 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -176.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 63' ' ' LEU . 12.5 t80 -64.86 -56.26 14.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 169.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.07 -38.32 65.16 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 119.336 -0.364 . . . . 0.0 111.608 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.2 3.22 24.5 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mp 48.13 53.63 11.41 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.769 2.027 . . . . 0.0 114.779 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.55 -55.23 5.0 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.781 0.8 . . . . 0.0 111.326 170.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.98 -27.31 61.33 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -167.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m 67.94 164.88 0.23 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.597 1.159 . . . . 0.0 113.354 175.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -44.51 -45.48 9.29 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.178 1.391 . . . . 0.0 112.367 -169.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -36.05 -48.89 0.62 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 126.487 1.915 . . . . 0.0 113.14 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.58 -47.84 6.35 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 44.8 mtt -50.31 -41.43 51.07 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.922 -171.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.59 -21.33 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -176.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -89.22 -45.13 9.78 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.448 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -61.62 -39.74 92.36 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.36 0.664 . . . . 0.0 112.464 -174.012 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -57.89 -61.68 6.92 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.964 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.35 -39.86 73.2 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.455 1.437 . . . . 0.0 111.341 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 tt -51.5 -52.48 46.42 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.438 0.563 . . . . 0.0 111.155 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.3 -38.74 88.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.67 -0.644 . . . . 0.0 111.398 177.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.1 -48.09 79.46 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.299 0.499 . . . . 0.0 109.703 178.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -69.95 -36.25 75.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.217 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -52.82 -49.12 66.32 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 119.033 0.833 . . . . 0.0 109.644 169.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -52.42 65.73 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.14 -46.61 62.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.641 0.776 . . . . 0.0 110.733 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -64.57 -54.27 34.77 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.007 0.523 . . . . 0.0 110.466 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 C-N-CA 123.659 0.783 . . . . 0.0 110.488 -179.883 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp . . . . . 0 CA--C 1.53 0.182 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -51.39 -46.47 62.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.047 0.939 . . . . 0.0 111.405 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.8 -53.66 25.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.0 mt -54.59 -49.67 69.84 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.948 0.899 . . . . 0.0 111.876 -172.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.61 -60.95 2.98 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.07 0.85 . . . . 0.0 110.837 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.44 -55.87 11.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.659 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -49.42 -51.86 32.52 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.133 0.573 . . . . 0.0 110.748 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.26 -50.1 73.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.737 -0.602 . . . . 0.0 111.425 -174.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -60.2 -29.62 68.83 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.682 -0.636 . . . . 0.0 110.625 175.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.6 m -73.45 -42.57 61.78 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.476 -0.765 . . . . 0.0 109.44 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -52.26 -52.18 54.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -53.29 -54.93 29.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -55.72 -55.22 34.88 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.865 -0.522 . . . . 0.0 111.178 -178.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -60.49 -46.33 90.51 Favored 'General case' 0 C--O 1.224 -0.244 0 O-C-N 121.988 -0.445 . . . . 0.0 110.99 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -47.99 -51.93 21.86 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.675 1.19 . . . . 0.0 110.858 174.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.8 mt -60.36 -51.6 71.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 122.832 0.453 . . . . 0.0 109.876 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -56.34 -40.43 74.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.792 0.724 . . . . 0.0 112.105 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.47 -15.13 62.78 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.149 0.98 . . . . 0.0 111.565 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.78 19.83 79.74 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 123.754 0.692 . . . . 0.0 111.871 -177.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -52.7 -55.15 12.61 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 171.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.41 -49.63 14.95 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.654 0.661 . . . . 0.0 112.04 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.16 -54.37 46.65 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.118 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.24 82.69 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.705 0.802 . . . . 0.0 111.454 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.2 mmm -51.21 -46.13 62.12 Favored 'General case' 0 C--N 1.333 -0.112 0 C-N-CA 125.241 1.416 . . . . 0.0 109.54 169.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -58.1 5.12 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 125.317 1.436 . . . . 0.0 111.882 168.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.45 -50.03 75.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.526 0.33 . . . . 0.0 111.307 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -65.54 -49.41 69.01 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.273 0.488 . . . . 0.0 111.75 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -132.43 -55.42 0.96 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.193 0.997 . . . . 0.0 111.318 -169.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.98 142.26 3.37 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 108.531 -1.827 . . . . 0.0 108.531 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -81.14 74.8 8.13 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.142 0.971 . . . . 0.0 109.397 -174.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -98.02 26.09 5.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.148 167.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -141.99 42.71 1.69 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.27 -0.893 . . . . 0.0 110.073 -168.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.5 m -79.33 173.58 12.44 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -46.88 -44.45 19.63 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.646 0.778 . . . . 0.0 111.834 -171.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 p -48.84 -66.58 0.38 Allowed 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.206 1.402 . . . . 0.0 112.015 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -69.24 -40.7 77.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.714 0.806 . . . . 0.0 111.513 -173.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -61.39 -44.33 98.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.755 -0.591 . . . . 0.0 110.238 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 56.4 m -58.67 -45.06 90.23 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.014 -0.428 . . . . 0.0 110.621 170.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -40.24 66.67 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.541 0.736 . . . . 0.0 111.316 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 67' ' ' LEU . 47.7 t80 -66.41 -60.36 2.83 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.311 1.045 . . . . 0.0 110.911 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -62.29 -26.37 68.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.02 8.13 34.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.858 0.863 . . . . 0.0 111.807 172.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp 43.64 36.38 1.23 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 126.752 2.021 . . . . 0.0 113.089 -178.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 -32.59 59.37 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.8 mt -57.76 -14.66 6.16 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.527 0.731 . . . . 0.0 112.183 168.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.2 m 72.58 -65.97 0.33 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.893 1.677 . . . . 0.0 113.728 168.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -169.26 -52.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.465 0.706 . . . . 0.0 110.443 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -37.62 -57.21 0.98 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.256 1.823 . . . . 0.0 113.295 -173.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -81.97 -43.64 17.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.676 0.751 . . . . 0.0 110.159 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 58.7 mtp -43.53 -42.51 5.01 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 125.023 1.329 . . . . 0.0 112.388 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.1 t -63.06 -21.55 66.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -90.7 -47.2 7.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.098 0.959 . . . . 0.0 109.487 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.64 -52.47 6.36 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.202 1.801 . . . . 0.0 110.371 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -61.47 -57.95 21.83 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 117.493 -1.241 . . . . 0.0 112.096 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -44.27 -49.27 8.96 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.43 2.087 . . . . 0.0 112.295 170.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 mp -60.53 -50.44 73.53 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 -172.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.413 HD12 ' CE2' ' A' ' 50' ' ' PHE . 7.4 mt -64.64 -35.62 81.61 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.07 0.548 . . . . 0.0 111.985 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -62.26 -48.65 78.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -58.25 -46.89 85.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.405 173.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -52.07 -50.21 61.99 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.432 0.56 . . . . 0.0 111.047 175.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -42.26 89.8 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.844 0.458 . . . . 0.0 109.825 -173.002 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -53.46 -58.98 5.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.125 0.488 . . . . 0.0 109.879 170.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -58.91 -47.5 84.77 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.264 0.626 . . . . 0.0 110.404 -171.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.338 0 C-N-CA 124.794 1.238 . . . . 0.0 111.543 177.432 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -51.08 -46.99 61.95 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.597 1.159 . . . . 0.0 111.169 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.2 mp0 -69.33 -43.98 72.6 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.32 -51.47 45.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.79 1.636 . . . . 0.0 112.098 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -56.49 21.35 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.978 0.894 . . . . 0.0 109.637 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -52.31 -53.96 37.64 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.396 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -51.15 -53.11 37.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.65 1.18 . . . . 0.0 111.003 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.4 -48.09 81.79 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.908 0.483 . . . . 0.0 110.463 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.34 -37.29 86.69 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.145 0.498 . . . . 0.0 111.521 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.4 m -65.71 -36.68 84.32 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 121.81 -0.557 . . . . 0.0 109.884 176.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -56.73 -45.1 82.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.393 0.542 . . . . 0.0 111.142 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -59.47 -49.14 78.94 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.036 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -59.28 -46.94 87.18 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.881 -0.512 . . . . 0.0 110.519 -177.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -63.41 -45.01 92.97 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.492 0.717 . . . . 0.0 110.319 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -54.24 -48.24 71.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.506 0.722 . . . . 0.0 110.246 174.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.3 mt -61.9 -40.69 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.051 0.54 . . . . 0.0 109.82 177.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -61.04 -43.17 99.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.446 0.567 . . . . 0.0 111.26 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.27 -37.89 84.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.456 0.571 . . . . 0.0 110.244 170.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.37 35.72 9.32 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 124.637 1.113 . . . . 0.0 110.323 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 . . . . . 0 CA--C 1.523 -0.074 0 CA-C-O 121.477 0.656 . . . . 0.0 109.876 179.259 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 70.6 t -55.53 -43.16 71.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 174.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.66 -51.0 51.47 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.71 -52.9 63.5 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.61 0.764 . . . . 0.0 110.292 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.13 74.06 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.711 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -44.85 92.25 Favored 'General case' 0 C--O 1.224 -0.255 0 O-C-N 121.842 -0.536 . . . . 0.0 110.196 175.083 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.5 -54.29 5.68 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 124.827 1.203 . . . . 0.0 111.374 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -62.56 -50.99 69.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.638 0.375 . . . . 0.0 111.577 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.28 -25.49 36.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -169.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -142.81 -60.74 0.43 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.572 1.149 . . . . 0.0 110.782 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 154.05 139.34 2.82 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 107.021 -2.431 . . . . 0.0 107.021 -169.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -82.24 69.42 8.97 Favored 'General case' 0 C--N 1.337 0.044 0 CA-C-N 118.481 1.141 . . . . 0.0 110.376 -170.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -92.44 35.18 1.02 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.01 0.524 . . . . 0.0 110.441 170.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -134.43 -52.8 0.83 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 121.506 -0.746 . . . . 0.0 111.771 -167.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p 30.36 -98.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.267 2.227 . . . . 0.0 112.567 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tm0? -125.23 -59.96 1.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.807 1.643 . . . . 0.0 108.831 172.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.45 -58.31 7.96 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 123.937 0.895 . . . . 0.0 112.755 -167.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -41.64 99.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.729 0.695 . . . . 0.0 111.342 -177.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -57.59 -47.43 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.964 0.802 . . . . 0.0 110.871 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -63.05 -45.97 89.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.961 -0.462 . . . . 0.0 110.17 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -59.2 -40.43 85.75 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.629 0.772 . . . . 0.0 111.485 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -60.52 -55.46 33.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.153 0.581 . . . . 0.0 109.945 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -59.43 -39.22 82.83 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.645 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.09 -5.85 38.27 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 173.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.9 mt 58.52 42.39 21.0 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.707 2.003 . . . . 0.0 111.825 176.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -79.79 -31.51 40.81 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.846 0.858 . . . . 0.0 111.805 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.55 31.05 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.949 1.462 . . . . 0.0 114.949 -168.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 92.3 p 55.06 -80.54 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.515 2.326 . . . . 0.0 113.595 -178.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -174.74 -38.89 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.612 2.365 . . . . 0.0 109.335 -176.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -44.89 -52.18 8.88 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.616 1.166 . . . . 0.0 112.738 -174.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -76.73 -47.09 22.89 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.7 mtt -41.49 -46.9 3.61 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 125.184 1.394 . . . . 0.0 112.334 -177.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.5 t -61.42 -27.52 68.61 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -82.64 -51.19 7.97 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -45.1 -46.32 11.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.884 2.074 . . . . 0.0 111.799 -176.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -64.26 -64.02 3.23 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.99 -174.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.56 -37.46 96.99 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.476 1.451 . . . . 0.0 111.081 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.98 -56.93 12.31 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.231 0.612 . . . . 0.0 111.027 175.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.9 mt -67.88 -35.56 78.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.103 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.22 -49.75 75.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.834 0.743 . . . . 0.0 109.96 176.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -66.99 -42.01 85.78 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -52.21 -47.55 65.55 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 122.011 -0.43 . . . . 0.0 110.459 170.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -53.42 57.43 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -45.62 -53.56 9.01 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.89 0.876 . . . . 0.0 110.427 174.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.84 -45.71 91.33 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.79 -177.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.279 0 C-N-CA 123.736 0.814 . . . . 0.0 111.134 -176.75 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 N--CA 1.451 -0.389 0 CA-C-O 121.012 0.434 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp -40.14 -48.34 2.5 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.641 1.576 . . . . 0.0 111.35 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -53.97 -36.47 62.9 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.388 0.675 . . . . 0.0 112.558 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -79.87 -49.12 12.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.553 0.615 . . . . 0.0 109.443 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -51.78 -48.85 63.62 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.843 -0.599 . . . . 0.0 111.786 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -55.95 -62.71 1.52 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 118.801 0.728 . . . . 0.0 111.43 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -59.06 -43.62 91.73 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.612 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -56.0 -52.36 64.5 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 110.196 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -52.3 66.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.142 0.977 . . . . 0.0 110.327 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.66 -48.86 63.25 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.81 0.844 . . . . 0.0 109.884 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.6 m -62.29 -45.82 91.54 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.057 0.543 . . . . 0.0 110.64 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -54.91 -45.95 74.81 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.105 0.562 . . . . 0.0 109.568 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.9 -46.14 85.39 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.03 -0.419 . . . . 0.0 111.258 174.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -59.16 -46.79 87.46 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.248 0.931 . . . . 0.0 110.567 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -58.89 -46.45 87.82 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 122.184 -0.322 . . . . 0.0 110.518 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -55.17 -47.12 75.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.544 0.738 . . . . 0.0 110.948 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 81.9 mt -59.54 -46.96 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 123.109 0.563 . . . . 0.0 109.773 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -57.77 -42.02 83.21 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.468 0.576 . . . . 0.0 111.224 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.47 -15.66 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.24 33.04 72.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 -173.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -91.89 79.45 5.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 122.634 1.207 . . . . 0.0 109.091 -174.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 t -105.69 -178.03 3.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.666 1.986 . . . . 0.0 108.771 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 59.51 -71.87 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 127.585 2.354 . . . . 0.0 110.117 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -169.07 39.21 0.21 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 169.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -59.48 -49.8 76.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.946 1.373 . . . . 0.0 110.549 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.1 t -50.81 -50.44 23.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.267 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.83 -44.74 55.62 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.452 0.549 . . . . 0.0 112.389 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.41 -52.1 59.86 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 123.819 0.847 . . . . 0.0 110.396 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.33 -57.42 12.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.437 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 10.5 ttm -50.32 -42.49 52.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.546 1.138 . . . . 0.0 111.293 169.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.55 -54.28 6.61 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 124.721 1.153 . . . . 0.0 111.875 170.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -67.19 -49.08 65.92 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.61 0.364 . . . . 0.0 111.459 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.6 mt -71.66 -53.44 13.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.479 0.712 . . . . 0.0 112.49 -169.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -116.45 -58.18 2.11 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.836 1.654 . . . . 0.0 111.142 -169.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.35 152.38 7.61 Favored Glycine 0 CA--C 1.532 1.122 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 -171.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.63 60.91 1.73 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.283 1.433 . . . . 0.0 113.216 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -110.36 174.32 5.92 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.768 1.227 . . . . 0.0 108.029 172.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' HG12 ' A' ' 47' ' ' ILE . 74.9 m-85 66.7 39.88 3.46 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.379 1.072 . . . . 0.0 112.302 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -74.85 57.65 0.79 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.565 1.546 . . . . 0.0 109.855 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 72.53 -53.03 0.7 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.361 1.465 . . . . 0.0 111.25 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -41.66 -70.8 0.1 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 127.761 2.424 . . . . 0.0 111.715 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.96 -32.83 74.24 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.259 0.624 . . . . 0.0 111.461 -171.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.41 HG12 ' HB3' ' A' ' 42' ' ' PHE . 18.2 mm -60.52 -53.56 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 171.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -53.94 -48.37 70.31 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.999 -0.438 . . . . 0.0 110.535 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -56.71 -42.83 79.87 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.498 175.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -57.85 -55.52 33.8 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.876 0.47 . . . . 0.0 110.311 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -57.13 -38.03 72.87 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.551 176.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.28 -1.36 26.21 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.7 mp 51.26 30.58 5.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.231 1.813 . . . . 0.0 112.988 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -83.9 35.22 0.52 Allowed 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.897 -1.127 . . . . 0.0 111.004 -174.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.7 mt -139.86 19.66 2.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.666 1.586 . . . . 0.0 110.513 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.0 m 28.64 60.84 0.13 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.336 2.655 . . . . 0.0 116.029 169.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.2 t80 68.89 -58.59 0.49 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.51 1.924 . . . . 0.0 114.417 171.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -41.3 -56.0 2.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 113.262 -170.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -76.69 -49.69 15.5 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.565 0.698 . . . . 0.0 109.365 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 89.0 mtp -45.12 -44.8 10.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.602 1.561 . . . . 0.0 112.847 -173.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.9 t -59.77 -35.67 75.11 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.9 0.48 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.5 mttp -79.38 -35.97 39.92 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.644 0.778 . . . . 0.0 110.066 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' C ' HD12 ' A' ' 63' ' ' LEU 0.266 0.0 OUTLIER -65.32 -45.3 84.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.074 0.95 . . . . 0.0 112.132 -178.087 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -44.67 -62.25 1.7 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.212 1.005 . . . . 0.0 113.434 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -60.28 -34.53 93.66 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 121.974 1.783 . . . . 0.0 112.33 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.1 -48.28 80.87 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 mt -64.24 -38.76 92.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 118.108 0.413 . . . . 0.0 111.507 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.09 -51.62 69.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.91 0.777 . . . . 0.0 109.881 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -60.93 -39.06 87.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.545 0.338 . . . . 0.0 110.162 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -56.98 -44.8 83.06 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 121.761 -0.587 . . . . 0.0 109.916 173.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -47.32 86.36 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.921 0.888 . . . . 0.0 109.426 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.96 -46.65 78.53 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.974 0.509 . . . . 0.0 110.915 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -67.37 -51.2 54.99 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.568 1.147 . . . . 0.0 112.204 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 41.09 48.78 3.0 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 128.29 2.636 . . . . 0.0 113.959 -174.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 169.748 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 120.52 0.2 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.9 mp -46.11 -40.66 11.26 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.154 1.382 . . . . 0.0 112.257 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -47.74 -40.6 20.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.66 0.784 . . . . 0.0 111.98 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.35 -43.84 93.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.893 -0.505 . . . . 0.0 109.806 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.98 -49.1 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.426 1.09 . . . . 0.0 110.328 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -54.6 44.55 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.145 0.884 . . . . 0.0 110.882 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -55.14 -51.05 67.7 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -54.88 -49.7 70.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.882 0.473 . . . . 0.0 110.974 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.9 -51.35 67.91 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 110.651 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -62.59 -42.7 99.72 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.936 -0.477 . . . . 0.0 110.725 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.8 m -61.02 -44.94 96.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.174 0.589 . . . . 0.0 110.258 176.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -55.71 -48.33 75.34 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.811 1.244 . . . . 0.0 109.042 176.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -55.31 -45.13 76.33 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.183 173.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -59.18 -49.43 77.88 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.226 0.921 . . . . 0.0 110.645 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -55.29 -47.01 76.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.012 -0.43 . . . . 0.0 110.694 176.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.3 ttp85 -57.8 -45.05 86.65 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 110.949 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.9 mt -61.99 -46.75 95.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 C-N-CA 123.385 0.674 . . . . 0.0 109.822 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.28 -41.01 78.93 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.801 0.728 . . . . 0.0 110.848 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.99 -13.43 62.45 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 173.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.54 29.37 72.91 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 123.891 0.758 . . . . 0.0 111.286 -177.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -97.17 143.74 27.68 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 117.448 0.624 . . . . 0.0 109.821 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 t -165.71 -178.48 4.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 50.38 -107.4 0.27 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.746 1.618 . . . . 0.0 111.094 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.61 10.67 28.06 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 118.625 -1.097 . . . . 0.0 112.514 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.09 -61.94 2.24 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 119.613 1.707 . . . . 0.0 109.157 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.67 -40.4 79.23 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-O 118.622 -0.704 . . . . 0.0 109.339 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.15 -57.44 6.3 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 174.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.4 tp -60.71 -43.27 98.04 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.561 0.744 . . . . 0.0 109.725 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.574 ' HB1' ' HE1' ' A' ' 70' ' ' TRP . . . -59.52 -37.51 78.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.381 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 31.2 mmm -65.99 -45.98 79.65 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -38.38 -51.05 2.33 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 126.813 2.149 . . . . 0.0 111.919 172.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -57.43 -40.31 78.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.0 mt -99.5 -53.87 3.09 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.671 0.388 . . . . 0.0 111.547 -169.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -112.58 -48.68 2.99 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.709 1.604 . . . . 0.0 110.908 -169.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.02 155.59 6.48 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 108.681 -1.768 . . . . 0.0 108.681 -169.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -76.96 68.27 3.1 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.119 0.96 . . . . 0.0 110.273 -173.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -85.2 -58.45 2.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.346 0.658 . . . . 0.0 109.714 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -93.27 89.84 6.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.999 -0.438 . . . . 0.0 111.868 -168.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 m -100.34 -179.24 4.06 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 169.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -51.25 -36.28 41.17 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.7 p -53.04 -73.59 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.795 0.838 . . . . 0.0 109.82 172.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -43.33 65.74 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.547 1.139 . . . . 0.0 111.807 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.77 -48.04 81.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 O-C-N 121.504 -0.747 . . . . 0.0 111.47 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.7 p -56.01 -45.14 79.17 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.395 -1.441 . . . . 0.0 110.201 174.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -37.07 75.28 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.961 0.504 . . . . 0.0 111.915 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -58.88 -55.45 34.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.139 0.976 . . . . 0.0 110.012 173.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.15 -27.94 69.72 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.12 -4.34 56.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.5 0.72 . . . . 0.0 112.436 171.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp 53.96 31.44 13.47 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.071 2.148 . . . . 0.0 113.996 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -92.25 27.64 2.15 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.538 -0.726 . . . . 0.0 111.494 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 mt -128.85 31.06 5.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.901 1.68 . . . . 0.0 107.887 170.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 m -33.73 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 129.913 3.285 . . . . 0.0 114.704 -168.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 23.0 t80 68.65 -58.24 0.48 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.745 2.418 . . . . 0.0 113.323 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -43.14 -51.71 5.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.902 1.681 . . . . 0.0 113.074 -172.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -81.55 -48.32 11.95 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.9 mtt -43.84 -40.41 4.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 126.195 1.798 . . . . 0.0 112.761 -173.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.7 t -66.94 -23.37 65.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.085 -1.046 . . . . 0.0 113.063 -176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.62 -55.22 3.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.905 0.86 . . . . 0.0 108.701 169.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -48.02 -44.23 30.78 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.109 2.164 . . . . 0.0 112.294 -177.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -63.64 -62.95 4.53 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.436 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.55 -37.01 96.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.205 1.27 . . . . 0.0 111.881 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.0 -49.91 72.83 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.0 mt -61.88 -40.34 95.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.312 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -57.0 -53.7 55.12 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.78 0.718 . . . . 0.0 109.795 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -58.93 -46.02 88.98 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.679 0.392 . . . . 0.0 110.438 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.574 ' HE1' ' HB1' ' A' ' 33' ' ' ALA . 73.4 t90 -54.56 -45.09 73.42 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.479 0.312 . . . . 0.0 110.639 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.83 -44.44 85.55 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.01 -40.05 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.768 0.427 . . . . 0.0 110.503 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.69 -59.47 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.17 0.588 . . . . 0.0 111.488 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.82 69.8 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.266 1.026 . . . . 0.0 112.563 -169.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 . . . . . 0 N--CA 1.456 -0.162 0 C-N-CA 125.456 1.502 . . . . 0.0 112.251 -173.216 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.4 t70 . . . . . 0 N--CA 1.455 -0.223 0 CA-C-O 120.605 0.241 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp -50.66 -41.89 55.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.659 0.784 . . . . 0.0 111.394 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -53.86 -47.51 70.95 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.587 0.355 . . . . 0.0 110.967 173.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -65.55 -43.35 90.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.501 0.721 . . . . 0.0 110.053 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.14 -47.09 81.99 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.737 0.415 . . . . 0.0 110.404 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -56.63 18.96 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.546 0.738 . . . . 0.0 110.298 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -52.27 -54.18 34.51 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.738 0.815 . . . . 0.0 109.077 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -54.95 -49.92 70.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.634 0.774 . . . . 0.0 111.055 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.51 -52.97 60.28 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.159 0.89 . . . . 0.0 110.814 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -60.32 -38.69 84.49 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.49 -0.757 . . . . 0.0 111.132 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 85.7 m -65.2 -44.63 87.73 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.552 -0.717 . . . . 0.0 109.829 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -53.07 -54.06 41.05 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.807 1.243 . . . . 0.0 108.865 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.43 -52.33 62.12 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 177.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -56.65 -54.29 47.74 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.934 -0.479 . . . . 0.0 111.367 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -57.25 -48.32 79.16 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 122.094 -0.379 . . . . 0.0 110.528 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.7 ttp85 -50.79 -50.42 56.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.766 0.826 . . . . 0.0 110.569 176.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.78 -49.26 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 C-N-CA 122.979 0.512 . . . . 0.0 110.023 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -55.48 -42.41 74.32 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.82 0.737 . . . . 0.0 111.239 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.5 mt -68.54 -17.87 64.24 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.377 0.671 . . . . 0.0 112.075 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.93 25.7 75.16 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -87.44 92.41 9.07 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 122.096 0.95 . . . . 0.0 108.46 -176.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -51.82 159.52 0.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.17 1.388 . . . . 0.0 111.251 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -38.62 45.73 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.778 -0.576 . . . . 0.0 110.153 169.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.05 -57.42 16.64 Favored Glycine 0 CA--C 1.53 1.005 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 171.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -52.63 -53.02 52.6 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 117.454 0.627 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.87 -56.31 13.31 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.56 -48.77 34.74 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 123.811 0.72 . . . . 0.0 111.746 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.62 -54.86 29.22 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.451 0.643 . . . . 0.0 110.933 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.63 -48.97 77.98 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.964 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -40.3 81.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.471 0.708 . . . . 0.0 110.413 174.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -46.88 -55.89 8.0 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 125.004 1.287 . . . . 0.0 111.112 169.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -61.42 -48.22 82.17 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -80.99 -28.93 35.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -145.16 -63.53 0.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 111.049 -172.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.87 140.52 3.34 Favored Glycine 0 CA--C 1.529 0.945 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 -169.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.28 61.06 5.31 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 122.112 -0.64 . . . . 0.0 111.351 -168.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -81.64 -151.86 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 64.4 31.9 12.35 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.422 -0.799 . . . . 0.0 112.085 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -76.77 54.2 0.97 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.078 1.751 . . . . 0.0 110.235 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 66.39 -67.36 0.15 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.983 1.713 . . . . 0.0 109.99 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.2 p -28.45 -73.4 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 128.16 2.584 . . . . 0.0 111.838 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.8 m -53.49 -37.85 63.12 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.373 1.869 . . . . 0.0 112.714 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -75.02 -48.96 30.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 121.631 -0.668 . . . . 0.0 109.829 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.9 m -53.95 -48.77 69.94 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.587 -0.696 . . . . 0.0 110.652 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -58.52 -40.76 83.79 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.522 1.129 . . . . 0.0 110.936 176.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.461 ' CE2' HD12 ' A' ' 67' ' ' LEU . 4.2 t80 -57.56 -56.62 19.57 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.311 0.505 . . . . 0.0 110.31 175.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -65.55 -25.28 67.36 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.71 -5.13 44.17 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.058 0.845 . . . . 0.0 112.083 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 50.03 42.39 24.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.508 1.923 . . . . 0.0 111.552 -171.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -79.86 -34.68 39.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.78 0.832 . . . . 0.0 112.005 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.38 52.11 1.55 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.899 0.88 . . . . 0.0 111.931 -169.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 m -24.17 85.43 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.515 3.126 . . . . 0.0 116.757 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 t80 68.43 -57.76 0.48 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.759 2.424 . . . . 0.0 114.224 170.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -43.32 -50.98 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.198 1.799 . . . . 0.0 112.358 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -46.54 22.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.413 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 62.6 mtt -46.81 -44.91 19.68 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.913 1.285 . . . . 0.0 112.136 -172.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 22.2 t -64.39 -22.18 66.87 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -175.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.3 -51.91 5.32 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.063 0.935 . . . . 0.0 108.607 171.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 60' ' ' MET . 28.3 tp -47.1 -45.49 22.17 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 127.669 2.388 . . . . 0.0 112.041 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -63.66 -64.14 3.22 Favored Pre-proline 0 N--CA 1.453 -0.286 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.371 -176.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -56.28 -39.46 91.13 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 CA-C-N 120.87 1.346 . . . . 0.0 111.202 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tt -53.66 -57.7 9.85 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 123.005 0.522 . . . . 0.0 111.563 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 50' ' ' PHE . 83.2 mt -70.75 -31.18 67.91 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.151 0.58 . . . . 0.0 110.958 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.84 -46.17 89.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.73 -41.91 91.65 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.131 -0.356 . . . . 0.0 110.116 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -52.53 -46.73 66.85 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.156 0.434 . . . . 0.0 110.325 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.45 -46.78 86.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.11 -52.17 53.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.806 0.275 . . . . 0.0 110.638 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.79 -54.46 46.87 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.782 0.433 . . . . 0.0 111.709 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.52 -36.68 76.65 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.64 1.176 . . . . 0.0 111.652 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 CA--C 1.532 0.274 0 C-N-CA 126.908 2.083 . . . . 0.0 107.309 178.885 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 p30 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp -57.42 -43.26 83.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.017 0.527 . . . . 0.0 111.265 -174.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.31 -54.23 47.89 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.764 0.426 . . . . 0.0 109.966 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.97 -44.32 91.49 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.347 0.659 . . . . 0.0 110.95 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -57.93 -48.07 81.01 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.713 0.405 . . . . 0.0 110.712 176.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -55.84 29.79 Favored 'General case' 0 C--N 1.337 0.05 0 C-N-CA 123.134 0.574 . . . . 0.0 109.658 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -54.23 -51.91 63.0 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.67 0.388 . . . . 0.0 110.262 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -54.43 -53.76 49.89 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.452 0.701 . . . . 0.0 110.688 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.91 92.03 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.756 0.422 . . . . 0.0 111.114 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.5 ttpm? -56.36 -45.43 80.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.766 0.826 . . . . 0.0 109.798 174.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.3 m -63.57 -42.03 98.34 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.064 -0.397 . . . . 0.0 110.808 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -55.46 -51.1 68.06 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.35 -51.91 66.54 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.958 0.503 . . . . 0.0 110.85 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -45.97 88.73 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.745 -0.597 . . . . 0.0 110.421 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -65.98 -45.84 80.22 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.797 0.439 . . . . 0.0 109.848 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.4 ttp85 -50.58 -51.81 44.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 109.988 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 88.3 mt -59.42 -48.54 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.5 -42.46 78.38 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.4 0.546 . . . . 0.0 111.372 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.59 -16.23 63.79 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.7 0.8 . . . . 0.0 111.722 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.7 28.44 73.76 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -86.17 102.86 14.28 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -176.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -64.67 173.2 2.3 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.541 1.137 . . . . 0.0 111.718 -172.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mp0 -48.98 -48.91 42.95 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.855 1.262 . . . . 0.0 107.785 168.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.93 -55.7 26.61 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 124.595 1.093 . . . . 0.0 111.258 174.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.47 -58.25 7.8 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.036 0.918 . . . . 0.0 110.825 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.09 -48.38 89.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -176.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.92 -52.74 24.99 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 118.744 0.702 . . . . 0.0 111.659 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.11 -56.36 21.72 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.843 0.857 . . . . 0.0 110.46 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.73 -45.77 91.16 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.018 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mmm -55.51 -45.99 77.02 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 121.814 -0.554 . . . . 0.0 110.053 170.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.44 -57.08 4.55 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.754 1.168 . . . . 0.0 111.794 169.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -59.25 -50.5 73.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.787 0.293 . . . . 0.0 111.344 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.8 mt -78.14 -29.5 48.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -171.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -146.24 -61.4 0.31 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.127 0.971 . . . . 0.0 111.456 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 164.96 138.7 2.47 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 107.616 -2.193 . . . . 0.0 107.616 -169.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -78.73 38.87 0.33 Allowed 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.665 -0.903 . . . . 0.0 113.268 -168.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -81.38 41.75 0.63 Allowed 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.289 -0.882 . . . . 0.0 111.362 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -147.45 33.81 0.87 Allowed 'General case' 0 CA--C 1.524 -0.033 0 C-N-CA 124.094 0.958 . . . . 0.0 109.971 -169.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.6 m -73.07 64.58 0.73 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.814 1.246 . . . . 0.0 110.266 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 68.96 -60.56 0.45 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.413 1.885 . . . . 0.0 111.972 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 m -45.12 -66.3 0.42 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.9 1.28 . . . . 0.0 111.797 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.49 -41.07 69.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.267 1.027 . . . . 0.0 111.729 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.7 mm -64.73 -43.79 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.483 0.713 . . . . 0.0 109.991 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.6 p -65.42 -43.34 90.84 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.751 -0.593 . . . . 0.0 110.731 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -58.88 -45.94 89.02 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 118.51 0.596 . . . . 0.0 109.707 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -55.73 -57.95 9.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.254 1.022 . . . . 0.0 110.327 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -62.19 -34.99 77.5 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 -3.86 30.06 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 172.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 59.1 28.78 18.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.953 1.701 . . . . 0.0 111.926 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.35 -34.69 58.94 Favored 'General case' 0 C--N 1.333 -0.125 0 O-C-N 121.133 -0.98 . . . . 0.0 109.002 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 68.5 mt -62.98 -5.05 2.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 112.388 170.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.0 m 69.91 -65.16 0.32 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.722 1.609 . . . . 0.0 115.18 166.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -166.18 -53.28 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.826 0.739 . . . . 0.0 111.489 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -46.37 -51.54 14.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.924 0.889 . . . . 0.0 113.202 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -77.73 -52.15 9.4 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.6 mmm -38.04 -51.22 1.38 Allowed 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 126.338 1.855 . . . . 0.0 111.267 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 31.3 t -65.8 -29.28 69.74 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -84.63 -40.39 17.52 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.975 0.893 . . . . 0.0 108.978 175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -67.74 -35.02 77.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.844 1.257 . . . . 0.0 113.584 -176.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -50.33 -67.39 0.47 Allowed Pre-proline 0 CA--C 1.536 0.406 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.885 173.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -57.75 -37.03 98.01 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.907 1.738 . . . . 0.0 111.394 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tt -53.6 -55.38 26.27 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.611 0.764 . . . . 0.0 111.117 173.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.3 mt -66.71 -31.9 72.86 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.781 -0.574 . . . . 0.0 112.02 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.09 -47.71 78.98 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.573 -0.704 . . . . 0.0 109.254 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -64.2 -39.98 95.12 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 119.245 -0.407 . . . . 0.0 110.608 175.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 68.8 t90 -52.42 -49.1 65.21 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.459 0.572 . . . . 0.0 110.181 169.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.72 -47.48 85.07 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -175.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.81 -53.27 50.94 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.823 0.449 . . . . 0.0 110.69 175.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.82 -50.09 75.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.674 0.39 . . . . 0.0 111.41 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.58 -34.67 78.42 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.903 1.281 . . . . 0.0 111.449 -175.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 N--CA 1.453 -0.28 0 C-N-CA 125.021 1.328 . . . . 0.0 110.687 -179.273 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 . . . . . 0 CA--C 1.534 0.342 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mp -41.0 -53.41 2.98 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.882 1.673 . . . . 0.0 112.958 -169.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -52.48 -40.6 62.51 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.935 0.894 . . . . 0.0 111.902 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -70.58 -54.37 12.32 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.5 mt -52.25 -52.96 49.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 112.102 -171.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.18 -59.73 4.28 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.57 0.7 . . . . 0.0 111.588 -174.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -53.24 -60.22 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.411 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -50.6 -50.19 54.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.187 0.995 . . . . 0.0 111.35 -172.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.32 -53.24 60.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.556 0.693 . . . . 0.0 110.476 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -65.49 -22.74 66.76 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.66 -0.65 . . . . 0.0 111.542 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 57.6 m -75.96 -40.38 54.08 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.366 -0.834 . . . . 0.0 109.455 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.62 -48.44 72.21 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 170.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.2 tttp -54.38 -55.65 26.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.699 0.285 . . . . 0.0 111.671 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -57.41 -52.07 66.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.746 -0.596 . . . . 0.0 111.218 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpt85 -60.26 -44.67 95.08 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.161 0.584 . . . . 0.0 110.421 -178.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 58.9 ttp85 -52.72 -49.41 65.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.073 0.949 . . . . 0.0 110.482 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 75.1 mt -59.66 -46.87 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-O 119.128 -0.463 . . . . 0.0 110.059 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -57.02 -42.12 79.82 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.085 0.857 . . . . 0.0 111.299 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.24 -18.42 65.34 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.741 0.416 . . . . 0.0 112.086 174.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.09 24.43 74.6 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 -172.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -85.67 92.97 8.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 122.609 1.195 . . . . 0.0 108.492 -175.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.8 t -62.12 167.71 3.79 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.987 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.81 -53.9 4.38 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.73 1.212 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -51.34 -47.52 50.35 Favored Glycine 0 CA--C 1.529 0.965 0 C-N-CA 124.267 0.937 . . . . 0.0 112.818 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -63.45 -52.12 62.79 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.423 1.111 . . . . 0.0 109.507 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.4 t -57.74 -52.43 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.22 -48.51 47.0 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.39 -56.92 15.19 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 117.494 0.647 . . . . 0.0 110.167 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.401 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.03 -46.22 90.22 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.894 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -47.02 60.99 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.957 1.303 . . . . 0.0 109.41 170.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -48.8 -59.15 6.95 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.943 1.259 . . . . 0.0 112.307 169.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.25 -47.81 77.79 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 117.06 0.43 . . . . 0.0 111.409 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.1 mt -73.5 -50.35 21.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 5.9 m-85 -126.3 -59.05 1.33 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.938 0.895 . . . . 0.0 112.0 -168.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 158.55 135.1 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -169.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -82.39 73.6 9.41 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.699 -0.883 . . . . 0.0 110.331 -170.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.79 27.67 2.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.311 167.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -148.13 47.17 1.07 Allowed 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.852 -0.53 . . . . 0.0 110.403 -167.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.2 p -60.04 -59.88 4.71 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.921 0.888 . . . . 0.0 109.154 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -159.29 -54.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.062 1.345 . . . . 0.0 109.029 -177.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.0 p -48.69 -69.74 0.11 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.414 1.485 . . . . 0.0 111.023 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.2 m -49.12 -49.14 43.48 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.22 1.408 . . . . 0.0 111.363 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.6 mm -60.21 -47.8 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.993 0.917 . . . . 0.0 110.533 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m -62.59 -48.19 80.54 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.205 -0.309 . . . . 0.0 110.475 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -36.88 82.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.284 0.634 . . . . 0.0 110.925 178.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -63.6 -52.28 61.61 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 118.671 0.669 . . . . 0.0 110.639 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -58.22 -33.25 69.11 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.661 0.784 . . . . 0.0 112.082 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.47 8.89 22.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.066 0.946 . . . . 0.0 112.373 172.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.5 mp 36.83 44.88 0.38 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.64 2.376 . . . . 0.0 113.459 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -85.52 -53.05 5.43 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.713 1.205 . . . . 0.0 108.955 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.87 101.61 0.22 Allowed 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.11 -179.89 1.36 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.053 1.741 . . . . 0.0 114.357 -167.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -40.53 -46.79 2.56 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.825 1.65 . . . . 0.0 113.906 -169.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -41.46 -46.16 3.37 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.249 1.42 . . . . 0.0 112.555 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -79.02 -58.43 3.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.69 0.796 . . . . 0.0 108.886 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 41.4 mtt -44.95 -49.89 10.86 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.785 1.234 . . . . 0.0 112.117 -170.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.4 t -66.19 -36.95 84.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.629 -169.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -74.01 -43.18 58.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.498 0.666 . . . . 0.0 109.677 172.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.3 tp -64.64 -46.5 82.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.864 0.866 . . . . 0.0 112.003 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -52.33 -56.55 21.27 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.961 -173.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.06 -36.51 89.07 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 CA-C-N 121.247 1.481 . . . . 0.0 111.824 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.407 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.4 mp -61.21 -52.08 66.29 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -63.14 -38.9 93.0 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.349 0.66 . . . . 0.0 111.341 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -58.74 -51.94 67.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -64.08 -40.05 95.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.282 -0.261 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.401 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 54.4 t90 -53.78 -46.72 71.11 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 172.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.64 -46.23 80.03 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.89 -51.81 59.82 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.016 0.526 . . . . 0.0 110.906 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -58.73 -50.95 72.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.359 0.664 . . . . 0.0 111.099 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.19 96.41 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.022 0.929 . . . . 0.0 111.382 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 N--CA 1.453 -0.286 0 C-N-CA 125.922 1.689 . . . . 0.0 111.24 -176.036 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.122 0.487 . . . . 0.0 110.39 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -66.38 -8.1 23.43 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -169.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -54.49 -36.98 64.74 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.053 -1.029 . . . . 0.0 109.49 168.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -61.96 -50.26 72.83 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.283 0.633 . . . . 0.0 109.741 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -55.69 -43.39 76.38 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 124.358 1.063 . . . . 0.0 109.688 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -55.48 22.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.592 0.757 . . . . 0.0 109.397 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -54.08 -56.23 20.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -50.63 -54.11 25.44 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.184 0.594 . . . . 0.0 110.992 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.74 -50.38 73.7 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.785 -0.572 . . . . 0.0 110.475 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -28.02 68.76 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.73 -0.606 . . . . 0.0 111.384 176.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 90.1 m -70.92 -45.47 64.19 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -55.04 -44.31 74.56 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.728 0.411 . . . . 0.0 110.08 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -55.97 -54.1 48.88 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.99 -0.444 . . . . 0.0 110.741 174.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -55.1 -46.33 75.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.995 -0.441 . . . . 0.0 111.002 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -53.44 -50.68 64.75 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.186 0.448 . . . . 0.0 110.298 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -54.34 -48.01 71.88 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.559 0.618 . . . . 0.0 111.658 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.39 -54.86 20.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.399 0.545 . . . . 0.0 109.724 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -55.52 -43.85 76.09 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.082 0.401 . . . . 0.0 111.148 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.05 -14.25 60.21 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.355 0.662 . . . . 0.0 112.279 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.16 34.88 87.53 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -173.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -90.13 92.17 8.85 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 122.146 0.974 . . . . 0.0 110.182 -176.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.6 t -124.83 -171.59 2.39 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.144 2.178 . . . . 0.0 107.96 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 57.95 -72.21 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.553 2.741 . . . . 0.0 111.284 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -173.43 39.37 0.14 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 170.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -57.5 -55.77 30.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.522 1.161 . . . . 0.0 109.654 177.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.7 t -50.39 -49.61 23.44 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.992 171.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.9 -46.33 32.11 Favored Glycine 0 CA--C 1.527 0.809 0 C-N-CA 123.816 0.722 . . . . 0.0 113.75 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.3 -50.89 68.3 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.28 1.04 . . . . 0.0 110.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.424 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.93 -52.42 65.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.158 -178.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -37.96 58.29 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.886 1.274 . . . . 0.0 109.772 169.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -49.72 -59.83 6.98 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 125.612 1.577 . . . . 0.0 111.16 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -62.84 -39.91 95.83 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.517 0.198 . . . . 0.0 111.306 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.0 tp -84.87 -23.91 28.77 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -168.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -148.96 -65.19 0.23 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.398 1.879 . . . . 0.0 110.601 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 177.27 139.95 3.49 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 -169.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.7 62.46 5.54 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 117.521 0.661 . . . . 0.0 112.355 -167.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -92.24 -155.04 0.4 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.44 40.44 20.76 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 120.843 -1.161 . . . . 0.0 113.894 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -75.51 50.48 0.54 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.092 1.357 . . . . 0.0 108.901 169.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 67.29 -42.28 0.43 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.182 1.793 . . . . 0.0 112.023 -167.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -42.26 -70.49 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.955 2.102 . . . . 0.0 113.216 -173.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 p -65.41 -40.46 93.41 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.54 -0.725 . . . . 0.0 110.409 -174.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.1 mm -54.37 -41.31 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.167 0.987 . . . . 0.0 110.712 173.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.5 m -68.62 -48.37 64.25 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.482 -0.761 . . . . 0.0 109.782 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -58.81 -33.65 70.62 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.756 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.18 -52.29 36.12 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 126.216 1.806 . . . . 0.0 110.531 174.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -60.6 -23.8 64.98 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.62 0.768 . . . . 0.0 112.455 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.03 -6.32 55.67 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 0.0 112.463 169.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.77 41.15 32.13 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 127.075 2.15 . . . . 0.0 112.095 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.29 -7.18 24.85 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.8 mt -83.73 50.53 1.82 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.753 1.16 . . . . 0.0 111.176 -175.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 42.62 31.23 0.28 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.897 2.879 . . . . 0.0 116.038 170.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 t80 67.84 -50.81 0.52 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.21 1.804 . . . . 0.0 113.019 -174.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -38.45 -53.46 1.54 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.593 1.957 . . . . 0.0 112.786 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.88 -49.02 19.09 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 mtp -47.78 -47.2 30.81 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.626 1.571 . . . . 0.0 110.699 -174.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.5 t -59.17 -34.37 72.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.688 0.795 . . . . 0.0 113.106 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -85.37 -36.03 21.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.007 0.908 . . . . 0.0 110.124 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -62.93 -38.74 92.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.223 1.009 . . . . 0.0 110.661 -178.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -53.04 -64.08 1.9 Allowed Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.797 176.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -58.46 -39.02 87.37 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.027 1.818 . . . . 0.0 111.679 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -53.18 -52.58 58.35 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.877 0.762 . . . . 0.0 111.182 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.8 mt -69.35 -36.52 76.95 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.706 -0.621 . . . . 0.0 111.99 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -57.56 -49.76 75.33 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.835 0.743 . . . . 0.0 109.045 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -63.74 -42.24 97.91 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.529 0.332 . . . . 0.0 110.137 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.424 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 71.5 t90 -52.84 -47.04 68.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.217 0.462 . . . . 0.0 110.585 170.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -51.12 70.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -47.53 74.33 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.044 0.538 . . . . 0.0 110.335 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -59.13 -52.88 63.8 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.437 0.695 . . . . 0.0 110.575 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.51 -48.62 74.36 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.219 0.607 . . . . 0.0 110.181 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.883 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 t70 . . . . . 0 N--CA 1.451 -0.42 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.91 -15.19 28.43 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.149 0.431 . . . . 0.0 111.504 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -48.99 -47.71 44.04 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.387 1.075 . . . . 0.0 110.855 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -57.53 -45.86 84.53 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.349 0.26 . . . . 0.0 110.988 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.53 -53.12 61.31 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 124.573 1.149 . . . . 0.0 110.832 -175.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -57.66 11.83 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.216 0.462 . . . . 0.0 110.581 -177.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -54.93 -49.48 71.22 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -55.44 -50.61 69.37 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.341 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.72 -51.9 64.16 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.348 0.976 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp -59.77 -38.38 81.69 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.0 m -64.9 -44.7 88.72 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 121.706 -0.622 . . . . 0.0 109.78 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.52 -48.76 68.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.736 1.214 . . . . 0.0 109.544 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.95 -45.49 92.46 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 174.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.11 -45.35 83.5 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.013 -1.054 . . . . 0.0 111.247 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -60.95 -44.58 97.07 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 121.547 -0.721 . . . . 0.0 110.576 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -50.09 -48.97 52.95 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.657 0.783 . . . . 0.0 110.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -61.25 -51.26 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 122.951 0.5 . . . . 0.0 110.047 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -56.44 -41.39 76.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.892 0.769 . . . . 0.0 112.228 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.88 -12.06 61.19 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.698 0.799 . . . . 0.0 111.752 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.79 33.39 87.12 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -173.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -79.27 116.35 19.47 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 58.8 p -81.16 58.23 3.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.858 1.263 . . . . 0.0 110.071 -168.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 54.27 -75.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.75 2.42 . . . . 0.0 112.788 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -52.93 -27.73 30.23 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.374 0.988 . . . . 0.0 112.22 175.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -54.02 -40.33 66.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.568 0.684 . . . . 0.0 111.117 173.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -58.43 -52.22 61.92 Favored 'Isoleucine or valine' 0 C--N 1.342 0.244 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 172.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.96 -50.54 15.19 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 123.454 0.549 . . . . 0.0 111.885 174.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.7 tp -59.51 -57.57 12.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 117.723 0.762 . . . . 0.0 111.107 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.35 97.29 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.103 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.413 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 66.9 mmm -55.34 -44.1 75.6 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.762 -0.586 . . . . 0.0 110.052 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.76 -57.83 5.1 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 124.728 1.156 . . . . 0.0 111.299 169.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -57.44 -50.17 73.88 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 35.2 mt -83.37 -25.61 31.23 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -169.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -145.88 -61.37 0.33 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.55 1.14 . . . . 0.0 111.046 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 166.11 137.48 2.22 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 107.641 -2.184 . . . . 0.0 107.641 -169.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.07 36.44 0.23 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -167.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -83.33 38.51 0.61 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.096 -1.003 . . . . 0.0 111.414 -172.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -152.75 42.79 0.63 Allowed 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 124.377 1.071 . . . . 0.0 109.671 -169.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 p -56.2 -62.05 1.97 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 170.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -154.43 -47.64 0.09 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.474 1.11 . . . . 0.0 111.106 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -47.66 -67.07 0.31 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.969 1.308 . . . . 0.0 114.295 -169.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 12.5 p -56.79 -49.43 75.35 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.047 0.939 . . . . 0.0 110.341 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.4 mm -53.89 -47.74 63.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.753 1.221 . . . . 0.0 110.909 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.9 m -60.02 -48.17 82.81 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.226 -0.921 . . . . 0.0 110.121 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -59.11 -31.15 68.66 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.165 0.586 . . . . 0.0 111.298 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.62 -57.62 7.7 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 124.092 0.957 . . . . 0.0 110.051 174.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.33 -26.45 68.77 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.87 -6.92 59.24 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.665 0.666 . . . . 0.0 112.428 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.9 mp 48.03 49.39 17.26 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.706 2.003 . . . . 0.0 113.082 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.0 -32.1 27.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.657 0.783 . . . . 0.0 110.678 174.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 42.0 mt -81.18 46.17 0.9 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.825 0.85 . . . . 0.0 112.511 -168.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 m -21.93 85.35 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 129.28 3.032 . . . . 0.0 116.568 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.3 t80 69.25 -57.37 0.53 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.352 2.261 . . . . 0.0 114.025 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -46.09 -51.54 13.67 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.465 1.506 . . . . 0.0 112.519 -172.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -46.47 30.27 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtt -46.95 -44.37 19.93 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.944 1.298 . . . . 0.0 111.715 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.3 t -60.72 -29.82 69.59 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -84.49 -47.49 10.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.273 1.035 . . . . 0.0 109.245 172.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.1 -40.58 70.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.164 1.786 . . . . 0.0 111.764 -175.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -60.58 -66.9 1.25 Allowed Pre-proline 0 CA--C 1.536 0.414 0 CA-C-O 117.995 -1.003 . . . . 0.0 111.039 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.61 -40.14 80.35 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.193 1.929 . . . . 0.0 111.726 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.04 -57.02 11.79 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.255 0.622 . . . . 0.0 111.299 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.1 mt -69.53 -35.0 75.05 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -58.71 -49.81 76.22 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.996 0.816 . . . . 0.0 110.131 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -44.94 90.65 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.413 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 76.7 t90 -50.96 -48.82 60.92 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.165 -0.335 . . . . 0.0 110.843 172.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.19 -51.86 67.23 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.78 -46.01 74.36 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.768 0.427 . . . . 0.0 110.316 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.66 -53.08 61.82 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.113 0.565 . . . . 0.0 110.489 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.63 73.29 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.227 0.611 . . . . 0.0 110.204 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.675 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 110.602 -0.147 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -45.4 -39.96 7.55 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.35 1.46 . . . . 0.0 112.239 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -45.46 -47.59 13.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.004 0.922 . . . . 0.0 111.255 174.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.41 -47.31 84.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -52.22 60.66 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.222 1.009 . . . . 0.0 111.572 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -53.35 57.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.511 1.051 . . . . 0.0 110.974 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -59.88 -40.88 90.21 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.881 -0.512 . . . . 0.0 110.93 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -54.4 -51.17 65.7 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 121.717 -0.614 . . . . 0.0 109.98 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.64 -46.89 77.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.728 0.694 . . . . 0.0 111.821 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.2 -40.91 82.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.311 0.576 . . . . 0.0 111.036 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.7 m -63.28 -43.85 96.73 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.49 -0.756 . . . . 0.0 109.668 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -60.94 -45.22 95.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.551 1.141 . . . . 0.0 110.174 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -49.14 -52.16 27.94 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.143 0.429 . . . . 0.0 110.262 170.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -59.83 -50.87 72.11 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.797 -0.564 . . . . 0.0 111.257 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -55.85 -48.83 74.82 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.559 0.618 . . . . 0.0 110.59 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.3 ttp85 -52.84 -47.61 67.62 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 110.61 176.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 67.2 mt -60.11 -46.58 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.116 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -58.2 -40.88 82.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.191 0.905 . . . . 0.0 111.276 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.23 -13.1 59.79 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.933 -0.479 . . . . 0.0 112.112 173.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.87 27.74 73.59 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -88.99 113.59 24.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -174.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.4 p -77.52 35.55 0.19 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.933 1.693 . . . . 0.0 112.986 -168.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 63.08 -57.97 0.16 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.641 1.976 . . . . 0.0 112.267 -172.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -45.99 -41.45 10.76 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.016 0.817 . . . . 0.0 111.802 170.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -54.71 -51.48 65.46 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 117.507 0.654 . . . . 0.0 110.889 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.1 t -57.7 -45.34 86.75 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.96 -51.18 25.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 123.686 0.66 . . . . 0.0 112.226 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.54 -50.96 65.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.97 0.908 . . . . 0.0 110.85 -178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.63 79.06 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.534 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 66.3 mmm -55.13 -47.41 75.09 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.075 0.95 . . . . 0.0 110.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.57 -53.29 3.61 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.212 1.387 . . . . 0.0 111.472 170.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -66.08 -55.05 18.46 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -75.29 -34.58 61.32 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -168.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -133.32 -56.59 0.91 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.422 1.089 . . . . 0.0 110.864 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.67 152.54 6.93 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 107.609 -2.197 . . . . 0.0 107.609 -170.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.05 65.77 5.32 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.169 0.985 . . . . 0.0 111.71 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -92.04 177.91 6.03 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.99 -1.855 . . . . 0.0 105.99 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 70.81 21.35 5.18 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.041 0.937 . . . . 0.0 112.882 168.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.3 m -75.01 73.06 2.19 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 169.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 72.41 -69.62 0.18 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 126.517 1.927 . . . . 0.0 112.312 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -46.4 -60.41 2.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.834 1.254 . . . . 0.0 112.159 -168.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.5 m -60.5 -31.55 70.58 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.605 0.762 . . . . 0.0 112.595 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -73.89 -40.8 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 119.013 0.824 . . . . 0.0 109.626 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.0 t -58.94 -53.59 56.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 171.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -58.29 -42.64 87.04 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.486 0.715 . . . . 0.0 111.261 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.1 -62.36 1.68 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 124.294 1.038 . . . . 0.0 109.95 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -62.7 -35.89 81.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.507 -174.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.63 -8.68 44.29 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.43 40.08 27.6 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.998 1.319 . . . . 0.0 110.559 -173.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -79.8 -32.79 40.79 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.574 0.75 . . . . 0.0 110.361 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 mt -81.24 45.19 0.83 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.556 0.742 . . . . 0.0 110.828 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.6 m -15.54 77.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 130.311 3.444 . . . . 0.0 116.763 -169.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.0 t80 69.22 -57.11 0.53 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.501 1.92 . . . . 0.0 114.249 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -39.04 -55.61 1.55 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.712 2.005 . . . . 0.0 113.363 -174.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -73.85 -52.67 12.24 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 122.07 0.938 . . . . 0.0 108.601 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.8 mtp -48.37 -38.57 19.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.537 1.535 . . . . 0.0 113.593 -170.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.78 -30.39 71.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -83.14 -42.28 17.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.607 0.718 . . . . 0.0 109.459 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.262 0.1 OUTLIER -62.86 -37.94 88.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.608 0.763 . . . . 0.0 112.407 -172.735 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -54.6 -67.21 0.7 Allowed Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.959 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.45 -41.58 74.65 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.328 2.019 . . . . 0.0 111.421 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.468 ' C ' HD23 ' A' ' 66' ' ' LEU . 2.4 tt -50.26 -49.86 51.92 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.935 0.494 . . . . 0.0 111.274 171.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 67' ' ' LEU . 11.7 mt -67.65 -42.66 81.9 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 118.953 0.797 . . . . 0.0 111.77 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -55.52 -48.55 74.48 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -62.9 -44.78 95.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.762 0.425 . . . . 0.0 110.843 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -52.53 -49.41 64.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.429 0.559 . . . . 0.0 110.264 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.4 -47.78 77.88 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.986 0.914 . . . . 0.0 109.012 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -50.86 -56.75 10.77 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.134 0.492 . . . . 0.0 110.547 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -60.4 -42.96 97.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.52 0.728 . . . . 0.0 110.217 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -88.83 31.88 0.83 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.133 0.973 . . . . 0.0 111.187 174.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 123.949 0.9 . . . . 0.0 110.83 -176.264 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp -53.01 -40.89 64.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.011 0.524 . . . . 0.0 111.508 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -57.06 -57.08 14.14 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.66 -38.81 92.52 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 119.717 -0.182 . . . . 0.0 111.297 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.8 mt -58.48 -44.79 89.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.073 173.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.88 -52.18 64.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.197 0.908 . . . . 0.0 108.932 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.46 -53.89 48.15 Favored 'General case' 0 CA--C 1.529 0.135 0 O-C-N 122.146 -0.346 . . . . 0.0 110.147 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -52.08 -49.13 64.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.945 1.298 . . . . 0.0 110.351 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.53 -51.87 68.05 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.309 0.644 . . . . 0.0 111.173 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -57.21 -45.77 83.53 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.721 0.772 . . . . 0.0 110.005 175.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 m -61.01 -31.51 71.13 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.73 -0.606 . . . . 0.0 110.164 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -62.24 -28.96 70.06 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.308 -0.87 . . . . 0.0 110.987 175.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -65.48 -50.54 64.97 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 121.406 -0.809 . . . . 0.0 110.016 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -58.65 -40.88 84.73 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.954 -0.466 . . . . 0.0 110.496 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.4 mtm180 -67.28 -43.49 81.65 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.401 0.68 . . . . 0.0 110.862 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 42.9 mtm180 -49.27 -55.56 12.27 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.08 0.855 . . . . 0.0 109.895 169.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.72 -50.77 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -54.54 -44.6 73.0 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.249 0.62 . . . . 0.0 111.48 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.0 -9.19 58.03 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.04 29.29 74.37 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.067 0.849 . . . . 0.0 111.124 -171.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -96.14 166.18 11.87 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.591 1.156 . . . . 0.0 109.821 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.2 t -146.34 176.62 9.64 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -57.59 -50.71 72.24 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.49 1.116 . . . . 0.0 111.248 -168.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.21 -45.73 92.36 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -65.16 -44.87 87.12 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.81 0.444 . . . . 0.0 110.03 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.08 -48.47 78.92 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 171.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.67 -54.59 8.87 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.781 0.705 . . . . 0.0 111.423 173.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 tp -60.4 -54.85 40.69 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.645 0.778 . . . . 0.0 111.054 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.13 -47.14 84.21 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.758 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -43.6 83.79 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.84 -0.537 . . . . 0.0 109.962 173.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.93 -55.7 6.22 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.827 1.203 . . . . 0.0 111.35 169.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.26 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.8 mt -85.66 -25.02 26.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -169.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -143.88 -64.52 0.37 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.117 1.367 . . . . 0.0 110.72 -174.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.97 143.06 3.71 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -171.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.18 71.95 8.18 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -172.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -107.48 26.91 9.67 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.528 0.731 . . . . 0.0 111.865 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -142.75 21.95 1.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -169.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 59.2 m -68.85 84.88 0.32 Allowed 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 169.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.282 4.2 pm0 58.25 -62.89 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 129.507 3.123 . . . . 0.0 113.806 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.3 m -33.46 -70.72 0.07 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.092 2.557 . . . . 0.0 112.953 -175.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 m -59.27 -38.76 80.89 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.091 1.357 . . . . 0.0 112.408 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.38 -35.51 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 122.977 0.511 . . . . 0.0 110.086 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -65.94 -50.41 64.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -56.25 -36.9 69.07 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.745 0.818 . . . . 0.0 111.278 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -60.36 -59.53 5.25 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.865 0.866 . . . . 0.0 110.054 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -56.42 -41.17 75.93 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.499 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.36 -3.45 24.06 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . 0.289 0.6 OUTLIER 40.56 51.82 2.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 127.236 2.214 . . . . 0.0 113.175 -170.828 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -79.39 -43.79 22.73 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.384 1.074 . . . . 0.0 110.838 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -80.22 58.65 3.1 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.699 0.8 . . . . 0.0 110.623 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.1 m -27.56 91.97 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 129.262 3.025 . . . . 0.0 116.121 -171.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 53.2 t80 67.49 -58.68 0.42 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.252 2.221 . . . . 0.0 114.63 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -44.13 -50.55 8.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.571 1.548 . . . . 0.0 112.56 -173.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.4 -54.51 12.13 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.694 0.759 . . . . 0.0 109.287 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.02 -43.41 19.53 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.669 1.588 . . . . 0.0 112.478 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.46 -32.36 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -83.5 -44.02 15.15 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.721 0.772 . . . . 0.0 109.262 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.5 tp -57.42 -42.16 81.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.278 1.031 . . . . 0.0 112.099 -176.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -58.68 -61.51 7.55 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.41 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -58.95 -38.77 86.28 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.721 1.614 . . . . 0.0 111.251 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tt -53.14 -54.13 40.28 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.865 0.757 . . . . 0.0 111.402 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.79 -39.12 87.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.797 0.439 . . . . 0.0 111.333 177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -58.69 -47.35 84.81 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.547 0.612 . . . . 0.0 109.856 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -64.31 -45.69 86.85 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.09 0.556 . . . . 0.0 110.143 177.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -50.95 -48.02 60.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.645 0.26 . . . . 0.0 110.425 173.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -51.41 69.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.422 1.089 . . . . 0.0 109.426 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -45.69 77.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.99 -54.6 35.76 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.85 76.17 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.293 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 CA--C 1.533 0.295 0 CA-C-O 121.161 0.505 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.9 mt -52.44 -40.66 62.48 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.442 0.697 . . . . 0.0 112.327 -176.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.77 -39.65 52.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.563 0.745 . . . . 0.0 111.687 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -79.52 -48.08 14.48 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -53.13 -46.99 69.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.462 0.705 . . . . 0.0 111.71 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.09 -60.06 4.15 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.069 0.85 . . . . 0.0 111.658 -176.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -48.29 -52.05 23.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.862 175.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -54.46 -51.23 65.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.034 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.23 -52.71 63.45 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.84 0.746 . . . . 0.0 110.69 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -57.04 -46.41 82.44 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.574 0.702 . . . . 0.0 110.711 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.5 m -60.56 -39.76 89.13 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 123.112 0.565 . . . . 0.0 110.274 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -58.62 -49.15 78.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.934 0.893 . . . . 0.0 109.196 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -56.49 -52.74 63.59 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 122.446 -0.159 . . . . 0.0 110.908 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -52.74 -53.48 47.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.779 0.432 . . . . 0.0 110.666 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -54.63 -54.01 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.77 0.828 . . . . 0.0 110.187 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.0 ptt85 -63.19 -36.8 84.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.987 -0.446 . . . . 0.0 110.985 -174.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 73.8 mt -55.2 -56.03 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 170.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -55.13 -41.31 71.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.131 0.423 . . . . 0.0 111.683 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.6 mt -73.1 -14.7 61.44 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.76 20.61 77.59 Favored Glycine 0 CA--C 1.533 1.157 0 O-C-N 121.343 -0.848 . . . . 0.0 111.368 -170.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -86.19 74.5 10.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.481 1.134 . . . . 0.0 109.272 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 t -146.16 -168.84 3.1 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.036 -1.438 . . . . 0.0 109.677 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 64.73 -66.45 0.13 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 128.047 2.539 . . . . 0.0 111.018 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.17 -6.13 0.4 Allowed Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.366 0.984 . . . . 0.0 113.122 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.03 -56.98 12.89 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 119.069 1.435 . . . . 0.0 111.273 -171.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 ' CZ2' ' A' ' 70' ' ' TRP . 94.0 t -58.23 -50.37 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -53.76 10.84 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 175.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.18 -52.82 52.62 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.545 0.738 . . . . 0.0 111.018 -174.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -58.82 -47.71 83.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.455 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.57 85.41 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 121.978 -0.451 . . . . 0.0 109.916 173.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.72 -56.55 4.97 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 125.218 1.39 . . . . 0.0 111.131 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -61.88 -51.77 66.83 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 87.5 mt -77.12 -29.11 54.61 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -168.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -143.51 -63.34 0.4 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.491 1.517 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.12 145.75 4.74 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.63 71.08 7.49 Favored 'General case' 0 N--CA 1.461 0.115 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -172.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -107.69 19.96 19.46 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.597 0.759 . . . . 0.0 111.9 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -143.63 33.02 1.28 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -168.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.4 m -72.2 75.05 0.97 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 169.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 68.07 -62.22 0.36 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 127.589 2.356 . . . . 0.0 112.765 172.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -30.33 -77.85 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 128.319 2.648 . . . . 0.0 113.104 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 m -55.62 -38.21 69.2 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.791 0.836 . . . . 0.0 111.938 -174.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -66.74 -44.43 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 m -57.59 -43.71 84.86 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.065 -1.022 . . . . 0.0 109.629 172.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -64.57 -33.06 75.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.184 0.993 . . . . 0.0 111.901 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -63.37 -53.66 49.09 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 109.659 172.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -37.23 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.81 -14.92 63.21 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.057 -0.402 . . . . 0.0 111.827 171.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.0 mt 59.59 42.96 16.51 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.611 1.964 . . . . 0.0 111.604 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -78.5 -31.62 47.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.836 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.78 5.12 0.23 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -169.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.6 m 40.4 58.94 2.19 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.073 1.749 . . . . 0.0 114.549 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.2 t80 68.41 -58.08 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.008 2.123 . . . . 0.0 114.529 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -47.14 -51.45 18.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.864 1.266 . . . . 0.0 112.885 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.2 -43.38 42.69 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.8 mtt -46.82 -45.24 19.98 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 124.54 1.136 . . . . 0.0 111.421 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 t -60.83 -29.31 69.41 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -177.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -83.09 -45.98 13.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.993 0.902 . . . . 0.0 109.387 171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -56.04 -44.28 78.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.932 1.693 . . . . 0.0 111.963 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -60.95 -59.92 12.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.516 -0.755 . . . . 0.0 111.785 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -58.6 -41.21 66.54 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.421 1.414 . . . . 0.0 111.217 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -49.99 -54.35 20.61 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 175.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.7 mt -68.93 -35.31 76.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.773 -0.579 . . . . 0.0 111.565 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -56.66 -50.05 73.23 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.409 0.55 . . . . 0.0 109.597 174.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -60.5 -49.04 79.14 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.921 0.489 . . . . 0.0 110.02 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.408 ' CZ2' HG22 ' A' ' 30' ' ' VAL . 67.6 t90 -49.23 -50.01 40.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.033 0.379 . . . . 0.0 111.009 174.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -48.48 75.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -175.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.32 -42.64 74.01 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 123.075 0.55 . . . . 0.0 111.139 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.52 -51.35 57.59 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.423 0.289 . . . . 0.0 111.116 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.48 -53.26 11.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.735 0.814 . . . . 0.0 112.163 -169.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 125.238 1.415 . . . . 0.0 111.951 -169.93 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp -49.86 -37.2 29.94 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.613 1.165 . . . . 0.0 110.807 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 55.5 mp0 -49.54 -40.12 36.97 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.566 1.546 . . . . 0.0 111.594 175.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.97 -49.98 14.24 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.9 mt -59.25 -44.88 92.36 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.885 0.474 . . . . 0.0 111.593 -172.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -64.86 -56.78 11.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.237 0.542 . . . . 0.0 111.0 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -48.46 -54.55 13.76 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.892 1.277 . . . . 0.0 110.293 172.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -51.45 -53.14 40.11 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.62 -52.1 60.96 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.548 0.339 . . . . 0.0 110.654 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -61.5 -28.38 69.26 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.584 -0.697 . . . . 0.0 111.84 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.3 m -69.76 -43.59 71.93 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.017 -1.052 . . . . 0.0 108.968 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.48 -42.04 81.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.553 0.741 . . . . 0.0 109.829 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -55.25 -56.25 22.09 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.027 -0.42 . . . . 0.0 110.113 172.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.71 -45.53 81.79 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.929 -0.482 . . . . 0.0 111.07 -178.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -53.24 -53.75 46.2 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.196 0.598 . . . . 0.0 110.105 174.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.2 mtm105 -53.62 -55.89 21.93 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.445 0.298 . . . . 0.0 110.817 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.1 mm -51.7 -51.68 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.992 0.917 . . . . 0.0 109.111 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.55 -40.5 71.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.392 0.277 . . . . 0.0 111.363 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.6 mt -86.57 -2.32 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.53 25.07 71.33 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 121.092 -1.005 . . . . 0.0 112.6 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -79.42 102.12 8.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -178.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 33.3 p -148.82 -67.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.447 -164.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -36.02 -43.26 0.32 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.267 2.227 . . . . 0.0 113.207 173.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 147.61 22.17 0.09 OUTLIER Glycine 0 CA--C 1.528 0.868 0 C-N-CA 123.87 0.747 . . . . 0.0 112.88 176.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -51.66 -58.24 6.93 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.487 1.143 . . . . 0.0 110.315 175.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -55.5 -45.7 78.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.97 -49.89 28.38 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 123.302 0.477 . . . . 0.0 112.762 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.26 -56.15 23.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.312 0.645 . . . . 0.0 109.925 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.07 -54.58 37.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.945 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 80.1 mmm -54.69 -44.19 73.15 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.714 1.206 . . . . 0.0 110.468 174.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -42.95 -56.09 4.59 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 125.328 1.442 . . . . 0.0 111.566 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.92 -49.85 64.25 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.765 0.283 . . . . 0.0 111.724 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.76 -34.56 64.77 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -134.78 -59.61 0.8 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.472 1.109 . . . . 0.0 110.93 -172.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.47 146.24 4.61 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 -171.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -81.89 69.59 8.61 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 117.646 0.723 . . . . 0.0 111.422 -169.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -106.41 -155.05 0.53 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 165.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 66.43 -82.13 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.975 0.91 . . . . 0.0 110.61 168.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m 45.05 -72.94 0.0 OUTLIER 'General case' 0 C--N 1.339 0.126 0 C-N-CA 130.011 3.324 . . . . 0.0 115.432 172.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -159.14 -50.33 0.06 Allowed 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.9 p -56.37 -72.28 0.08 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.244 1.017 . . . . 0.0 110.735 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.3 m -55.9 -37.55 69.04 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.494 0.718 . . . . 0.0 111.217 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.75 -42.68 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.618 -0.676 . . . . 0.0 111.871 172.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.4 m -65.23 -43.26 92.01 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.487 -0.758 . . . . 0.0 110.517 173.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -54.69 -47.4 73.72 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.609 0.64 . . . . 0.0 110.456 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -55.75 -59.18 5.23 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.898 1.279 . . . . 0.0 110.439 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -55.09 -38.17 67.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.1 0.96 . . . . 0.0 112.508 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.03 -8.95 58.85 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.254 1.022 . . . . 0.0 112.625 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 58.05 47.79 14.16 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.273 1.429 . . . . 0.0 110.784 -175.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.01 -47.91 15.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.052 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.14 96.57 1.09 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.9 p -68.12 81.55 0.22 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.565 0.746 . . . . 0.0 111.039 -174.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 78.4 t80 75.53 -48.56 0.61 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.97 2.108 . . . . 0.0 113.341 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -35.78 -61.52 0.47 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.504 1.922 . . . . 0.0 112.415 -169.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -79.78 -44.77 20.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.779 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.7 mtp -42.7 -45.52 4.75 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 125.028 1.331 . . . . 0.0 112.094 -174.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.1 t -60.64 -34.07 73.73 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -79.03 -44.47 22.15 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.082 0.944 . . . . 0.0 109.36 174.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -35.1 75.32 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.056 1.342 . . . . 0.0 113.406 -170.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -58.69 -61.62 7.33 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-O 117.769 -1.11 . . . . 0.0 112.395 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -58.74 -40.15 75.53 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.676 1.584 . . . . 0.0 110.982 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -51.66 -52.51 47.47 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.099 0.96 . . . . 0.0 111.387 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.1 mt -71.24 -33.89 70.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.558 -0.714 . . . . 0.0 111.525 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -57.68 -47.23 82.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -59.01 -47.83 83.78 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -51.11 -47.82 61.85 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.913 0.324 . . . . 0.0 110.565 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.49 94.68 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -41.08 81.06 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.878 0.471 . . . . 0.0 110.259 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -68.16 -52.66 32.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.919 0.39 . . . . 0.0 110.442 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.76 -34.81 64.87 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.328 1.051 . . . . 0.0 112.23 -171.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 124.99 1.316 . . . . 0.0 110.722 -175.354 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp -51.85 -41.58 61.93 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.382 0.673 . . . . 0.0 111.064 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -52.09 -42.4 63.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.432 0.693 . . . . 0.0 111.197 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -37.92 62.64 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.846 -0.534 . . . . 0.0 109.82 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.494 HD12 ' C ' ' A' ' 9' ' ' LEU . 0.1 OUTLIER -59.55 -46.36 89.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.445 -0.788 . . . . 0.0 111.476 178.126 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -58.77 -58.49 8.36 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.77 1.168 . . . . 0.0 111.175 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -46.22 -54.41 8.83 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.707 0.803 . . . . 0.0 110.189 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.24 -49.96 65.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.461 1.105 . . . . 0.0 111.087 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.23 -53.77 54.35 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.521 0.6 . . . . 0.0 110.496 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -56.91 -43.04 80.98 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.314 0.578 . . . . 0.0 110.751 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.2 m -60.99 -48.01 83.82 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -54.7 -47.29 73.88 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.379 0.672 . . . . 0.0 110.052 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.44 -47.36 82.01 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.204 0.456 . . . . 0.0 111.276 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.81 -44.78 82.32 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.903 -0.498 . . . . 0.0 111.001 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.4 mmt-85 -59.59 -46.15 89.8 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.607 0.639 . . . . 0.0 110.883 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -54.7 -46.99 74.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.34 0.656 . . . . 0.0 110.596 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt -61.26 -50.15 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.348 0.659 . . . . 0.0 109.812 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -47.44 67.36 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.822 0.849 . . . . 0.0 110.329 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -67.42 -12.97 61.55 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.751 0.82 . . . . 0.0 112.353 178.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.33 33.87 86.25 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -92.58 82.0 4.82 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.999 0.904 . . . . 0.0 108.972 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.5 t -110.1 -175.69 2.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.583 1.953 . . . . 0.0 108.808 -173.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 60.78 -71.02 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 128.017 2.527 . . . . 0.0 110.074 -175.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -171.32 38.23 0.17 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.901 1.239 . . . . 0.0 110.46 169.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.96 -51.31 70.15 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.028 1.414 . . . . 0.0 110.603 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -51.44 -46.48 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 172.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -55.47 -45.81 82.79 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 118.109 0.413 . . . . 0.0 112.517 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.99 -51.64 66.07 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 121.643 0.735 . . . . 0.0 110.41 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.1 85.51 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.752 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -42.23 80.3 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 124.097 0.959 . . . . 0.0 109.841 172.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -56.91 5.71 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 125.358 1.456 . . . . 0.0 111.154 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.65 -51.12 70.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.74 0.27 . . . . 0.0 111.615 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 mt -81.59 -25.21 35.93 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 115.135 1.531 . . . . 0.0 115.135 -168.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -143.31 -63.11 0.4 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.772 1.229 . . . . 0.0 111.133 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.27 145.28 5.18 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.79 56.5 3.08 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 117.839 0.82 . . . . 0.0 112.51 -167.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -88.6 -175.74 5.04 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 168.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 68.51 40.41 1.94 Allowed 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.972 -1.08 . . . . 0.0 112.634 169.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.3 p -74.96 52.5 0.55 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.965 1.306 . . . . 0.0 109.906 171.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 64.88 -44.86 0.33 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.541 1.936 . . . . 0.0 113.532 -169.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.1 p -44.12 -68.48 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.529 1.932 . . . . 0.0 111.864 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -35.54 73.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.843 0.857 . . . . 0.0 111.323 -174.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.0 mm -64.41 -46.67 92.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.257 0.623 . . . . 0.0 109.507 174.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.1 m -56.52 -45.6 81.0 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.983 -1.073 . . . . 0.0 110.22 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -57.04 -41.48 78.74 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.064 -0.397 . . . . 0.0 111.572 174.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -58.26 -52.61 64.86 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 122.973 0.509 . . . . 0.0 110.298 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.33 -27.47 69.05 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.8 -8.19 56.85 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.573 0.624 . . . . 0.0 111.87 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.31 42.14 25.38 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.987 1.715 . . . . 0.0 110.352 -171.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -79.77 -38.14 33.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.653 -173.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 mt -80.45 56.12 2.47 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.948 0.899 . . . . 0.0 112.873 -169.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.2 m 21.7 53.57 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 130.861 3.664 . . . . 0.0 116.94 169.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.1 t80 65.25 -57.32 0.3 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.321 2.249 . . . . 0.0 114.016 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -38.95 -53.09 1.77 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.447 1.899 . . . . 0.0 113.235 -175.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -72.7 -58.02 3.67 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.501 0.667 . . . . 0.0 109.217 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.3 mtp -44.1 -44.79 7.78 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.724 2.01 . . . . 0.0 112.256 -173.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.33 -31.62 72.9 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.811 0.845 . . . . 0.0 112.613 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -82.16 -37.83 25.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 171.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.071 0.948 . . . . 0.0 110.983 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -51.25 -68.32 0.4 Allowed Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.645 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.33 -37.63 94.22 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.862 1.708 . . . . 0.0 111.524 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -53.63 -54.06 43.01 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.678 0.672 . . . . 0.0 111.293 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 57.0 mt -67.65 -37.96 83.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 121.851 -0.531 . . . . 0.0 111.241 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -57.09 -49.97 74.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.349 0.522 . . . . 0.0 109.856 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -66.43 -42.61 87.43 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 122.246 -0.284 . . . . 0.0 110.482 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -50.59 -49.45 56.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.965 0.348 . . . . 0.0 110.173 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.24 -50.68 69.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -178.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -39.71 61.89 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.637 0.775 . . . . 0.0 111.15 178.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -71.82 -52.41 17.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 117.859 0.3 . . . . 0.0 110.82 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.85 -42.33 94.98 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.151 0.98 . . . . 0.0 112.354 -170.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 . . . . . 0 CA--C 1.53 0.204 0 C-N-CA 124.459 1.103 . . . . 0.0 110.756 -176.146 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.345 0.117 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp -47.38 -40.01 16.61 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.106 0.963 . . . . 0.0 110.709 175.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -49.87 -44.78 50.04 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.328 1.451 . . . . 0.0 111.776 174.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.01 -51.58 37.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.0 mt -53.4 -48.83 68.32 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.787 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -59.27 -61.65 2.47 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.066 0.848 . . . . 0.0 111.247 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -50.62 -52.69 37.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.725 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.52 -50.45 65.42 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.131 0.572 . . . . 0.0 111.1 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -53.1 61.77 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.393 0.677 . . . . 0.0 110.899 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -55.11 -47.02 75.58 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.319 0.58 . . . . 0.0 109.804 177.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.8 m -62.72 -39.09 92.96 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 123.238 0.615 . . . . 0.0 110.579 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -60.02 -51.39 69.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.208 1.003 . . . . 0.0 108.885 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -56.7 -53.69 54.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.398 0.279 . . . . 0.0 110.814 175.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.45 -52.64 53.06 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.662 -0.649 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -62.55 -48.06 81.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.371 0.668 . . . . 0.0 110.761 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 -57.64 -44.15 85.4 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.67 0.668 . . . . 0.0 109.451 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 84.9 mt -59.19 -47.76 89.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 O-C-N 122.081 -0.387 . . . . 0.0 110.003 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -56.36 -40.24 74.19 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.65 0.659 . . . . 0.0 111.503 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.2 mt -72.68 -1.39 16.12 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.48 25.49 74.11 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 121.236 -0.915 . . . . 0.0 111.664 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -91.39 101.51 14.19 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.871 0.868 . . . . 0.0 108.879 -178.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.4 p -76.68 39.38 0.21 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.889 2.076 . . . . 0.0 112.729 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 71.15 -56.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.796 2.038 . . . . 0.0 111.928 176.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -53.29 -40.93 61.38 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -49.11 -55.73 11.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.531 0.732 . . . . 0.0 110.799 173.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.7 t -58.09 -56.05 18.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.68 -49.05 12.53 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-N 118.095 0.407 . . . . 0.0 112.25 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.88 -52.56 65.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.709 1.204 . . . . 0.0 110.049 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.59 -47.72 78.94 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.844 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 48.3 mmm -56.15 -46.31 79.31 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 121.695 -0.628 . . . . 0.0 109.637 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -41.49 -56.65 3.45 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 125.546 1.545 . . . . 0.0 111.662 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -65.36 -50.41 65.65 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.361 0.665 . . . . 0.0 111.801 -178.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.89 -48.18 66.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.163 0.438 . . . . 0.0 111.959 -174.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 4.3 m-85 -126.41 -56.09 1.42 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.246 1.019 . . . . 0.0 111.154 -169.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.28 152.53 6.29 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 107.934 -2.066 . . . . 0.0 107.934 -169.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -81.02 54.35 2.19 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.887 -0.773 . . . . 0.0 111.076 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.69 -15.1 61.24 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.885 -0.51 . . . . 0.0 111.501 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.78 43.8 1.74 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.104 1.762 . . . . 0.0 107.725 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.6 p -61.65 -62.8 1.55 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.838 0.855 . . . . 0.0 110.349 -169.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.48 -55.31 0.05 OUTLIER 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.199 0.599 . . . . 0.0 112.226 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -52.93 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.407 1.083 . . . . 0.0 109.423 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 p -55.03 -51.53 66.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.184 0.994 . . . . 0.0 111.67 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -59.39 -46.98 92.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 O-C-N 122.02 -0.425 . . . . 0.0 110.71 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.0 m -56.43 -50.5 71.47 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.938 0.875 . . . . 0.0 110.77 175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -62.03 -30.1 70.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.765 1.226 . . . . 0.0 111.454 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -61.23 -57.4 12.56 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.176 0.591 . . . . 0.0 109.796 173.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.07 -30.52 68.13 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.61 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.34 -7.45 59.07 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.05 36.95 13.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.14 1.776 . . . . 0.0 112.106 -171.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -80.19 -31.57 38.74 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.844 -0.535 . . . . 0.0 111.861 -175.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -79.11 53.53 1.46 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.718 0.807 . . . . 0.0 111.554 -175.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.7 m -5.23 71.57 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 130.407 3.483 . . . . 0.0 116.49 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.7 t80 66.64 -57.81 0.39 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.938 2.095 . . . . 0.0 114.262 174.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.8 -55.56 3.6 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.517 1.527 . . . . 0.0 113.734 -169.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.18 -46.92 39.05 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 57.4 mtp -50.82 -42.11 58.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.342 1.457 . . . . 0.0 111.273 -173.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.4 t -64.36 -28.42 69.69 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.782 0.833 . . . . 0.0 112.663 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -82.7 -45.06 14.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.863 0.839 . . . . 0.0 109.425 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.267 0.1 OUTLIER -59.84 -46.92 87.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.819 1.247 . . . . 0.0 112.609 -178.249 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -55.12 -58.3 15.55 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -59.73 -34.81 95.96 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.848 1.698 . . . . 0.0 111.488 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.9 mp -63.69 -45.35 90.45 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 19.1 mt -62.9 -39.63 95.11 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 173.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.64 -50.37 74.1 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.899 0.772 . . . . 0.0 109.361 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.65 -47.8 81.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.358 0.663 . . . . 0.0 110.27 175.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -53.02 -43.45 66.56 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 122.228 -0.295 . . . . 0.0 110.487 174.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.88 -46.78 80.32 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -39.64 73.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.028 0.531 . . . . 0.0 110.611 176.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.52 -58.1 4.06 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.94 0.496 . . . . 0.0 111.537 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.77 -37.75 62.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.601 1.16 . . . . 0.0 112.158 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 . . . . . 0 C--O 1.233 0.219 0 C-N-CA 125.038 1.335 . . . . 0.0 111.748 -178.247 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.773 0.32 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp -50.91 -43.6 59.89 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.422 0.689 . . . . 0.0 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.4 mp0 -49.84 -45.43 50.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.198 1.399 . . . . 0.0 111.05 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.21 -48.36 57.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -55.79 -54.04 49.26 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.414 0.686 . . . . 0.0 111.444 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.04 -56.59 20.24 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-N 119.027 0.831 . . . . 0.0 111.137 -177.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.38 -54.88 18.5 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -54.21 -48.96 70.45 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.904 0.482 . . . . 0.0 110.744 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -52.37 65.81 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.142 0.977 . . . . 0.0 111.066 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -59.42 -46.97 87.21 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.627 -0.67 . . . . 0.0 110.122 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.8 m -60.71 -38.42 84.99 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 122.022 -0.423 . . . . 0.0 110.129 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.39 -46.28 90.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.847 0.859 . . . . 0.0 109.171 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -56.21 -50.67 70.6 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.266 0.484 . . . . 0.0 110.444 174.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -56.86 -48.5 77.97 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.162 -0.961 . . . . 0.0 110.885 178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -57.55 -42.37 82.84 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.934 -0.479 . . . . 0.0 111.061 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -54.64 -49.08 71.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.489 1.115 . . . . 0.0 110.349 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.2 mm -61.71 -48.82 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.233 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.95 -44.43 87.0 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.259 0.481 . . . . 0.0 111.389 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.2 mt -64.43 -37.98 89.44 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.255 0.622 . . . . 0.0 110.35 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.55 34.36 6.08 Favored Glycine 0 CA--C 1.525 0.719 0 C-N-CA 124.369 0.985 . . . . 0.0 111.348 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -79.42 74.97 6.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 122.938 1.351 . . . . 0.0 108.258 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.1 t -57.05 145.04 32.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.467 3.507 . . . . 0.0 111.765 -168.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 56.01 -77.71 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.029 1.732 . . . . 0.0 109.725 -172.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -160.9 46.56 0.39 Allowed Glycine 0 CA--C 1.523 0.558 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 169.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -61.53 -14.72 31.89 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.237 1.019 . . . . 0.0 111.952 -175.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.0 t -42.42 -43.46 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 124.28 1.032 . . . . 0.0 109.259 167.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.42 -45.63 16.68 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.125 0.869 . . . . 0.0 113.566 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.6 tp -70.07 -52.79 21.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.725 0.774 . . . . 0.0 109.87 -176.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.97 80.99 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.386 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.7 mmm -53.92 -47.3 71.33 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 110.318 170.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.48 -54.2 3.38 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 125.308 1.432 . . . . 0.0 111.461 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.62 -53.14 37.41 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 mt -76.15 -31.94 58.83 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -168.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -135.63 -56.69 0.79 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.461 1.105 . . . . 0.0 110.52 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.83 156.17 8.63 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -170.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.66 74.12 5.2 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.839 0.82 . . . . 0.0 110.489 -169.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -109.38 159.91 16.61 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 73.74 33.88 0.98 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.509 1.123 . . . . 0.0 113.771 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.4 m -75.05 65.29 1.45 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 64.05 -59.15 0.2 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.163 2.185 . . . . 0.0 112.5 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.1 p -32.19 -66.28 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.002 1.721 . . . . 0.0 113.081 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.17 -30.93 71.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.922 0.889 . . . . 0.0 112.383 -177.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 26.0 mm -67.15 -49.06 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.2 m -52.45 -53.61 43.18 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.579 -0.701 . . . . 0.0 110.373 173.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -59.36 -37.81 78.82 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.616 0.766 . . . . 0.0 111.364 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 63' ' ' LEU . 7.8 t80 -61.37 -60.3 3.93 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.268 0.627 . . . . 0.0 110.039 177.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.26 -41.59 76.05 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.12 -11.98 58.7 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 55.39 46.59 23.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.303 1.441 . . . . 0.0 110.911 -173.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -79.92 -41.12 26.73 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.439 1.095 . . . . 0.0 110.929 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.3 mt -77.91 -162.23 0.31 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.3 m -154.73 173.29 16.62 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 120.772 -1.205 . . . . 0.0 109.104 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -41.53 0.86 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.07 2.548 . . . . 0.0 112.07 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -39.61 -39.48 0.75 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.131 1.372 . . . . 0.0 112.023 176.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -104.75 -56.02 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.685 1.594 . . . . 0.0 109.743 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.0 mtt -47.15 -39.52 13.8 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.128 1.771 . . . . 0.0 113.945 -170.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.0 t -66.42 -25.31 66.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -90.03 -40.28 12.41 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.0 OUTLIER -55.93 -43.23 77.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.332 0.653 . . . . 0.0 111.814 -178.438 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -54.02 -65.77 1.12 Allowed Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 118.978 -0.534 . . . . 0.0 112.216 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -58.78 -40.75 69.69 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.891 1.728 . . . . 0.0 111.655 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 tt -49.19 -51.99 29.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 111.172 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.55 -40.21 80.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 121.775 -0.578 . . . . 0.0 111.275 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -61.68 -44.7 96.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.453 1.024 . . . . 0.0 110.259 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -61.65 -46.67 88.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.716 -0.615 . . . . 0.0 109.812 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -50.79 -46.58 59.7 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.791 0.269 . . . . 0.0 110.32 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.75 -48.85 79.93 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.761 0.824 . . . . 0.0 109.239 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -57.25 -48.82 77.88 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -57.6 -48.57 79.03 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.15 0.58 . . . . 0.0 109.64 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.5 33.38 0.7 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.61 1.164 . . . . 0.0 110.993 176.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 124.169 0.988 . . . . 0.0 110.937 -176.71 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.2 t0 . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp -41.6 -48.77 4.09 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 125.006 1.322 . . . . 0.0 111.484 -177.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -45.67 -47.53 15.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.241 1.416 . . . . 0.0 112.003 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -74.32 -49.66 21.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.73 -48.99 71.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.366 0.667 . . . . 0.0 111.496 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -61.19 -61.13 2.78 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.615 0.643 . . . . 0.0 110.843 -178.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -51.38 -48.28 62.61 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.413 0.685 . . . . 0.0 110.509 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -54.72 -51.83 64.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.763 0.425 . . . . 0.0 110.48 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.38 -52.83 58.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.35 0.523 . . . . 0.0 111.274 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -54.5 -46.45 73.47 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.896 0.379 . . . . 0.0 110.017 177.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.0 m -59.75 -42.54 93.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.821 0.449 . . . . 0.0 110.383 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -60.64 -44.87 95.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.844 0.458 . . . . 0.0 109.917 177.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -59.3 -48.92 79.81 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.724 -0.61 . . . . 0.0 111.079 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -55.45 -50.26 70.31 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.249 0.62 . . . . 0.0 110.141 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -52.01 -55.63 19.31 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.373 173.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -53.19 -49.27 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 110.439 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.1 mt -60.39 -44.94 97.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.539 0.736 . . . . 0.0 110.128 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -57.92 -41.37 82.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.749 0.704 . . . . 0.0 111.075 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.09 -10.81 59.95 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 173.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.15 73.88 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -94.62 154.96 17.1 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.623 0.769 . . . . 0.0 109.901 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -178.59 -174.83 0.4 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 -172.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 16.38 -84.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 129.12 2.968 . . . . 0.0 114.186 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 -33.36 40.62 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.927 -0.93 . . . . 0.0 113.479 -170.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -67.43 -70.86 0.23 Allowed 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.462 1.631 . . . . 0.0 112.809 -167.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.2 t -55.66 -41.02 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.9 -52.77 24.81 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.097 0.856 . . . . 0.0 112.993 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 tp -72.32 -47.52 49.1 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 117.997 0.898 . . . . 0.0 110.639 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.63 -51.71 64.55 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.288 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 62.4 mtp -64.56 -37.6 88.11 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 121.895 -0.503 . . . . 0.0 110.699 170.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -37.83 -56.75 1.68 Allowed Glycine 0 C--O 1.229 -0.206 0 C-N-CA 126.083 1.801 . . . . 0.0 111.262 172.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -76.1 -45.94 31.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.6 tp -72.02 -16.49 62.06 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -170.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -153.81 -64.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.856 1.662 . . . . 0.0 111.097 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.94 149.08 6.03 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 -169.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.93 67.77 8.05 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 117.746 0.773 . . . . 0.0 111.137 -168.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -121.76 170.73 9.46 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.501 1.52 . . . . 0.0 107.53 171.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.428 ' HB3' HG12 ' A' ' 47' ' ' ILE . 79.3 m-85 62.26 45.06 7.07 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.305 1.042 . . . . 0.0 111.44 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -62.53 -59.09 5.44 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.2 1.0 . . . . 0.0 109.072 169.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.59 -51.38 0.06 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.64 1.576 . . . . 0.0 108.849 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.9 p -50.63 -58.67 5.3 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.353 1.061 . . . . 0.0 111.742 -175.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.38 78.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.7 1.2 . . . . 0.0 111.1 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.428 HG12 ' HB3' ' A' ' 42' ' ' PHE . 7.8 mm -63.82 -56.54 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.799 0.84 . . . . 0.0 109.239 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.9 m -50.33 -45.38 54.82 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.215 -0.928 . . . . 0.0 111.275 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -60.8 -37.48 82.09 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.416 ' CD2' HD11 ' A' ' 63' ' ' LEU . 6.2 t80 -59.0 -55.49 34.46 Favored 'General case' 0 CA--C 1.522 -0.114 0 CA-C-N 118.71 0.687 . . . . 0.0 109.699 172.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.04 -31.46 70.0 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.8 -2.57 40.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.177 0.591 . . . . 0.0 112.421 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mp 53.52 35.75 21.59 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.88 1.672 . . . . 0.0 112.252 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -31.53 50.83 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.99 39.68 0.51 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.961 0.904 . . . . 0.0 109.937 176.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.8 m -37.83 94.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 128.864 2.866 . . . . 0.0 115.567 -167.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.9 t80 69.2 -56.89 0.54 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 128.197 2.599 . . . . 0.0 113.63 173.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -39.72 -51.6 2.33 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.535 1.934 . . . . 0.0 112.83 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -47.53 14.98 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.7 mtt -44.24 -40.09 4.91 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.458 1.903 . . . . 0.0 112.847 -169.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 24.2 t -65.07 -25.97 68.04 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 118.473 -1.291 . . . . 0.0 112.912 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -90.17 -45.16 9.28 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 169.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -56.95 -42.28 79.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 125.143 1.377 . . . . 0.0 112.476 -174.256 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.6 -62.0 6.83 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.362 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.96 -38.35 92.5 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.342 1.361 . . . . 0.0 111.735 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.31 -55.49 27.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.642 0.777 . . . . 0.0 111.449 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.38 -37.45 83.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 121.074 -1.016 . . . . 0.0 111.254 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -58.5 -47.85 82.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.594 -0.691 . . . . 0.0 109.276 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -61.55 -44.05 97.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.359 0.663 . . . . 0.0 110.085 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.7 t90 -52.49 -49.29 65.02 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.769 0.713 . . . . 0.0 110.563 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.25 -48.55 77.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.549 0.74 . . . . 0.0 109.427 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -56.55 -45.13 81.4 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 122.687 0.395 . . . . 0.0 110.654 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.67 -47.55 85.74 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.978 0.511 . . . . 0.0 110.86 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.54 -45.38 91.95 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.466 0.706 . . . . 0.0 110.998 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 . . . . . 0 CA--C 1.531 0.248 0 C-N-CA 124.278 1.031 . . . . 0.0 111.27 176.436 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.342 0.115 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.64 -40.4 62.74 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.165 0.586 . . . . 0.0 111.373 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -50.3 -37.17 35.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.572 1.149 . . . . 0.0 111.875 173.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -83.86 -45.01 13.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.986 0.514 . . . . 0.0 110.381 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.15 -46.87 62.16 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.657 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -57.76 -63.53 1.21 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.133 0.879 . . . . 0.0 111.511 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -55.7 -46.01 77.76 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.551 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.06 -52.41 64.37 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.98 0.512 . . . . 0.0 110.093 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.27 74.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.886 -0.509 . . . . 0.0 109.946 -177.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -56.19 -33.98 65.8 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.969 -0.457 . . . . 0.0 111.569 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.3 m -69.52 -40.43 76.93 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 121.469 -0.769 . . . . 0.0 109.449 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.27 -41.57 84.58 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -57.81 -51.6 68.93 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.97 -0.456 . . . . 0.0 110.814 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -55.57 -48.16 75.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.102 0.561 . . . . 0.0 110.417 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.67 -46.77 86.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.335 0.654 . . . . 0.0 110.771 176.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 mtm105 -55.15 -50.22 69.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.813 -0.554 . . . . 0.0 110.99 174.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.9 mt -54.71 -51.25 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -54.51 -45.36 73.28 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 122.678 0.391 . . . . 0.0 111.358 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 mt -74.16 -17.74 60.87 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.658 0.783 . . . . 0.0 112.368 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.02 32.19 72.99 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.051 0.834 . . . . 0.0 111.07 -170.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -95.01 124.34 39.0 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.811 0.844 . . . . 0.0 111.088 -173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -166.77 -168.83 1.2 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 -172.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 55.68 -73.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.553 2.341 . . . . 0.0 111.48 -173.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -167.46 34.88 0.21 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 124.141 0.877 . . . . 0.0 111.304 170.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.12 -53.13 59.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.486 1.143 . . . . 0.0 108.77 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.3 -48.46 32.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.939 170.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -49.99 17.63 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.275 0.94 . . . . 0.0 112.095 176.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 tp -62.39 -53.35 56.27 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.802 0.841 . . . . 0.0 110.702 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.94 78.12 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.366 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtp -55.39 -43.01 74.8 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 123.768 0.827 . . . . 0.0 110.233 169.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.24 -53.76 6.57 Favored Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.456 1.503 . . . . 0.0 111.73 168.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -62.65 -48.8 77.74 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.409 0.283 . . . . 0.0 111.373 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.65 -48.36 22.44 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 3.8 m-85 -125.12 -62.47 1.22 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.358 1.863 . . . . 0.0 112.952 -168.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.52 138.49 2.73 Favored Glycine 0 CA--C 1.531 1.089 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.52 59.15 4.5 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.506 0.722 . . . . 0.0 111.593 -167.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.57 -20.0 19.34 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -172.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -101.78 78.6 1.83 Allowed 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -166.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.5 t -73.47 171.14 13.7 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 165.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.28 -38.61 42.0 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -54.17 -57.76 9.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.569 1.147 . . . . 0.0 111.854 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -41.49 92.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.62 0.768 . . . . 0.0 110.109 -176.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -59.27 -43.2 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 122.015 -0.428 . . . . 0.0 110.966 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.2 m -59.12 -43.24 91.93 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 118.692 0.678 . . . . 0.0 110.093 174.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -47.87 61.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.611 0.364 . . . . 0.0 110.815 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.564 ' CD1' HD13 ' A' ' 63' ' ' LEU . 27.5 t80 -62.93 -54.93 30.89 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 122.37 0.268 . . . . 0.0 111.624 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.51 -23.24 66.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.096 0.958 . . . . 0.0 113.11 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.26 -7.62 59.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.844 0.858 . . . . 0.0 111.186 169.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp 52.24 44.34 29.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 126.387 1.875 . . . . 0.0 110.019 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -79.52 -33.58 41.9 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.024 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.5 mt -78.35 46.09 0.6 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.878 0.871 . . . . 0.0 112.621 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.3 t 60.77 -76.59 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.067 2.147 . . . . 0.0 113.179 174.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.1 t80 176.28 -47.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 126.554 1.942 . . . . 0.0 107.795 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -54.03 2.73 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.562 1.545 . . . . 0.0 112.995 -176.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -76.24 -56.45 4.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 37.9 mtp -38.33 -49.04 1.39 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.438 2.295 . . . . 0.0 112.178 -178.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.13 -41.7 84.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.0 0.92 . . . . 0.0 112.589 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -77.68 -34.72 52.81 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.3 0.64 . . . . 0.0 109.902 175.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.564 HD13 ' CD1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -53.77 -50.89 65.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.084 1.353 . . . . 0.0 110.511 177.611 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -46.2 -64.14 1.06 Allowed Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.26 -34.82 98.12 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 121.973 1.782 . . . . 0.0 111.837 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.5 mp -61.61 -51.99 66.24 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.57 -39.24 90.46 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.652 0.381 . . . . 0.0 111.283 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.15 -51.86 67.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.941 -0.474 . . . . 0.0 110.182 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.14 -43.5 98.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.7 0.4 . . . . 0.0 110.157 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -52.59 -45.29 66.44 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 172.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.11 -46.56 80.53 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.66 -40.92 66.31 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.985 0.514 . . . . 0.0 110.59 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -70.03 -55.3 9.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.769 0.428 . . . . 0.0 111.543 177.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.36 -46.05 51.44 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.17 0.988 . . . . 0.0 112.766 -169.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 . . . . . 0 CA--C 1.53 0.173 0 C-N-CA 125.68 1.592 . . . . 0.0 112.963 -172.139 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -44.01 -45.37 7.86 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 125.305 1.442 . . . . 0.0 112.356 -170.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -37.24 -51.75 1.04 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.116 1.366 . . . . 0.0 111.455 174.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.22 -48.73 78.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.795 0.838 . . . . 0.0 110.05 -178.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.42 -48.32 82.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.431 1.092 . . . . 0.0 110.155 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.09 -58.16 9.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.716 0.769 . . . . 0.0 109.896 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -56.32 -51.51 67.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.511 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -51.53 -52.86 43.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 110.822 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -53.48 44.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.032 0.833 . . . . 0.0 110.708 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -67.25 -12.54 60.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.2 m -90.29 -38.19 13.56 Favored 'General case' 0 C--O 1.228 -0.076 0 C-N-CA 124.129 0.972 . . . . 0.0 109.537 175.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -53.05 -44.83 67.72 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.848 0.859 . . . . 0.0 108.885 173.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -48.58 -56.86 7.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.245 0.618 . . . . 0.0 111.602 169.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -60.4 -49.38 77.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 O-C-N 121.991 -0.443 . . . . 0.0 110.483 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -55.95 -52.09 65.39 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.895 0.316 . . . . 0.0 110.188 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -50.99 -50.56 58.19 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.252 1.021 . . . . 0.0 110.786 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -59.98 -51.43 72.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.085 0.554 . . . . 0.0 110.253 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.23 -40.71 82.44 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.591 0.632 . . . . 0.0 111.532 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.5 mt -67.8 -16.3 64.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.696 0.799 . . . . 0.0 111.449 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.57 29.77 74.3 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -173.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -90.63 108.29 19.71 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.932 0.872 . . . . 0.0 109.147 -174.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 65.4 p -67.92 168.6 11.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.019 1.327 . . . . 0.0 109.859 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.67 -40.16 65.7 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 169.247 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.01 -55.32 29.82 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 173.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -56.03 -56.42 20.97 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 117.429 0.614 . . . . 0.0 110.735 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.6 t -59.17 -46.55 92.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.64 -52.6 24.23 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.9 tp -60.08 -54.47 45.6 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 123.518 0.727 . . . . 0.0 110.808 -178.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.85 91.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.127 -176.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.416 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 73.9 mmm -56.83 -45.15 82.51 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.803 -0.561 . . . . 0.0 110.084 171.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.54 -55.72 5.17 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 124.916 1.246 . . . . 0.0 111.224 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 tptp -52.93 -48.85 67.01 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.652 0.781 . . . . 0.0 112.293 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.6 mt -90.01 -35.91 15.24 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -169.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -132.57 -59.26 0.91 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.259 1.423 . . . . 0.0 110.889 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.98 142.69 3.46 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 107.85 -2.1 . . . . 0.0 107.85 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -79.41 38.36 0.36 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.309 1.054 . . . . 0.0 113.314 -168.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.56 39.11 0.59 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.463 -0.773 . . . . 0.0 111.134 -174.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -144.19 31.14 1.25 Allowed 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 125.51 1.524 . . . . 0.0 108.996 -169.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.7 m -76.66 67.25 2.74 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.488 1.115 . . . . 0.0 108.163 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 75.15 -48.0 0.62 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.524 1.929 . . . . 0.0 113.124 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.5 p -49.23 -79.41 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.075 1.35 . . . . 0.0 112.266 -172.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.2 p -54.31 -44.97 72.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.404 1.082 . . . . 0.0 110.525 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.34 -53.62 37.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.716 0.806 . . . . 0.0 111.202 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.8 p -60.35 -48.88 79.85 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.775 -0.578 . . . . 0.0 110.15 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -58.27 -34.95 71.06 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.423 . . . . 0.0 111.984 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -69.43 -53.05 21.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 123.629 0.772 . . . . 0.0 110.307 178.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -55.6 -40.25 71.82 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.832 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.88 -10.79 59.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.359 1.064 . . . . 0.0 112.838 173.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.4 mt 58.74 45.66 15.36 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 127.121 2.168 . . . . 0.0 112.767 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.32 -30.45 30.45 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.844 1.258 . . . . 0.0 111.119 176.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -80.26 47.92 0.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.981 0.912 . . . . 0.0 113.094 -168.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 m -16.99 84.31 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 129.545 3.138 . . . . 0.0 116.82 -171.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.2 t80 66.05 -58.08 0.34 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.714 2.406 . . . . 0.0 114.725 172.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -44.25 -50.54 8.84 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.612 1.565 . . . . 0.0 112.379 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -47.07 21.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.0 mtt -45.6 -46.15 14.17 Favored 'General case' 0 C--O 1.225 -0.237 0 C-N-CA 125.22 1.408 . . . . 0.0 111.636 -174.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.9 t -64.82 -22.78 67.06 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -174.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -90.04 -46.87 8.21 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.369 1.08 . . . . 0.0 108.696 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.23 -38.74 77.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.971 1.708 . . . . 0.0 111.734 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -61.39 -63.04 4.77 Favored Pre-proline 0 N--CA 1.452 -0.327 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.16 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -58.1 -39.94 81.27 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 CA-C-N 120.869 1.346 . . . . 0.0 111.181 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.62 -57.23 11.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.18 0.592 . . . . 0.0 111.433 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.2 mt -69.43 -34.11 73.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -58.38 -49.53 76.91 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.018 0.827 . . . . 0.0 109.08 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -62.29 -43.75 98.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.416 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 67.0 t90 -53.16 -49.53 66.42 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 117.906 0.321 . . . . 0.0 110.978 172.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -50.62 72.5 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -174.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -54.31 -53.01 59.62 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.37 0.668 . . . . 0.0 110.84 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -56.42 -51.87 66.76 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.378 0.671 . . . . 0.0 110.969 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.4 -49.39 76.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.312 0.645 . . . . 0.0 110.207 178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 173.83 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.7 t0 . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp -43.25 -40.81 3.61 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.403 1.881 . . . . 0.0 112.912 -169.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -40.15 -42.37 1.45 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.991 1.716 . . . . 0.0 112.467 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -74.59 -48.93 23.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.588 0.755 . . . . 0.0 110.244 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.11 -45.67 90.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.747 0.819 . . . . 0.0 111.088 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -57.43 -60.33 3.81 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.381 0.992 . . . . 0.0 111.04 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -56.91 -46.42 81.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.224 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -54.44 -48.6 71.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.329 0.513 . . . . 0.0 111.042 176.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.8 -51.41 67.19 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.614 1.166 . . . . 0.0 110.465 -176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -57.15 -45.28 83.73 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.502 0.668 . . . . 0.0 109.563 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.1 m -64.26 -32.18 73.67 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.909 -0.494 . . . . 0.0 110.494 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -63.28 -48.07 79.67 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.764 1.166 . . . . 0.0 109.345 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -52.3 -53.01 49.69 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 171.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -59.37 -44.35 92.73 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.649 -0.657 . . . . 0.0 111.81 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -59.12 -48.46 81.52 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.498 0.719 . . . . 0.0 110.312 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 64.9 ttp85 -52.04 -49.38 63.56 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.654 0.782 . . . . 0.0 110.252 175.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.03 -47.4 91.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 122.702 0.401 . . . . 0.0 110.143 178.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -59.26 -41.14 88.09 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.835 0.743 . . . . 0.0 111.604 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.53 -17.66 64.11 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.027 -0.42 . . . . 0.0 111.695 172.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.43 28.46 71.18 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -173.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -88.8 120.09 29.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.47 0.635 . . . . 0.0 109.793 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.39 147.29 51.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 167.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -54.19 -27.97 37.6 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.138 0.575 . . . . 0.0 110.524 170.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.32 -45.62 95.81 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 171.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -64.63 -46.82 80.96 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.4 t -52.93 -52.84 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.07 175.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.37 -49.38 45.15 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.266 0.46 . . . . 0.0 112.262 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.4 tp -62.4 -53.64 51.92 Favored 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 121.701 0.762 . . . . 0.0 110.872 -177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.97 92.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.745 0.818 . . . . 0.0 110.387 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -44.99 79.52 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.012 0.525 . . . . 0.0 109.747 171.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.08 -58.03 3.93 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.62 1.581 . . . . 0.0 111.352 169.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.8 -52.75 62.92 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.8 mt -75.34 -34.48 61.2 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -134.96 -59.5 0.79 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.087 0.955 . . . . 0.0 111.067 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 170.63 154.72 9.76 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 -171.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.12 68.24 4.11 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 123.604 0.761 . . . . 0.0 110.57 -169.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -112.29 172.69 6.76 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.59 1.956 . . . . 0.0 107.416 173.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 70.73 19.58 5.92 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -72.92 79.51 1.17 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 169.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 64.46 -67.16 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.412 2.285 . . . . 0.0 112.408 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 p -29.09 -75.45 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 127.829 2.452 . . . . 0.0 113.043 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -46.35 74.45 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.769 1.227 . . . . 0.0 111.251 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.6 mm -58.81 -49.92 81.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.484 1.114 . . . . 0.0 109.584 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.9 m -56.35 -54.1 49.47 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.83 -0.544 . . . . 0.0 110.226 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -71.05 -22.0 62.18 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -176.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 63' ' ' LEU . 12.5 t80 -64.86 -56.26 14.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 169.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.07 -38.32 65.16 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 119.336 -0.364 . . . . 0.0 111.608 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.2 3.22 24.5 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mp 48.13 53.63 11.41 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.769 2.027 . . . . 0.0 114.779 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.55 -55.23 5.0 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.781 0.8 . . . . 0.0 111.326 170.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.98 -27.31 61.33 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -167.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m 67.94 164.88 0.23 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.597 1.159 . . . . 0.0 113.354 175.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -44.51 -45.48 9.29 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.178 1.391 . . . . 0.0 112.367 -169.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -36.05 -48.89 0.62 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 126.487 1.915 . . . . 0.0 113.14 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.58 -47.84 6.35 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 44.8 mtt -50.31 -41.43 51.07 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.922 -171.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.59 -21.33 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -176.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -89.22 -45.13 9.78 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.448 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -61.62 -39.74 92.36 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.36 0.664 . . . . 0.0 112.464 -174.012 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -57.89 -61.68 6.92 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.964 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.35 -39.86 73.2 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.455 1.437 . . . . 0.0 111.341 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 tt -51.5 -52.48 46.42 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.438 0.563 . . . . 0.0 111.155 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.3 -38.74 88.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.67 -0.644 . . . . 0.0 111.398 177.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.1 -48.09 79.46 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.299 0.499 . . . . 0.0 109.703 178.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -69.95 -36.25 75.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.217 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -52.82 -49.12 66.32 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 119.033 0.833 . . . . 0.0 109.644 169.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -52.42 65.73 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.14 -46.61 62.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.641 0.776 . . . . 0.0 110.733 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -64.57 -54.27 34.77 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.007 0.523 . . . . 0.0 110.466 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.77 66.95 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.659 0.783 . . . . 0.0 110.488 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 169.745 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.618 0.247 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp -43.98 -45.37 7.77 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.602 1.161 . . . . 0.0 111.565 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -51.39 -46.47 62.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.047 0.939 . . . . 0.0 111.405 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.8 -53.66 25.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.0 mt -54.59 -49.67 69.84 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.948 0.899 . . . . 0.0 111.876 -172.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.61 -60.95 2.98 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.07 0.85 . . . . 0.0 110.837 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.44 -55.87 11.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.659 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -49.42 -51.86 32.52 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.133 0.573 . . . . 0.0 110.748 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.26 -50.1 73.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.737 -0.602 . . . . 0.0 111.425 -174.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -60.2 -29.62 68.83 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.682 -0.636 . . . . 0.0 110.625 175.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.6 m -73.45 -42.57 61.78 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.476 -0.765 . . . . 0.0 109.44 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -52.26 -52.18 54.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -53.29 -54.93 29.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -55.72 -55.22 34.88 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.865 -0.522 . . . . 0.0 111.178 -178.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -60.49 -46.33 90.51 Favored 'General case' 0 C--O 1.224 -0.244 0 O-C-N 121.988 -0.445 . . . . 0.0 110.99 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -47.99 -51.93 21.86 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.675 1.19 . . . . 0.0 110.858 174.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.8 mt -60.36 -51.6 71.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 122.832 0.453 . . . . 0.0 109.876 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -56.34 -40.43 74.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.792 0.724 . . . . 0.0 112.105 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.47 -15.13 62.78 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.149 0.98 . . . . 0.0 111.565 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.78 19.83 79.74 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 123.754 0.692 . . . . 0.0 111.871 -177.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -85.88 94.55 9.2 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.2 t -61.04 155.75 19.5 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.232 0.539 . . . . 0.0 110.406 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.43 75.55 1.04 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 168.82 -50.72 0.22 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 106.802 -2.519 . . . . 0.0 106.802 -169.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.25 -45.91 91.18 Favored 'General case' 0 C--N 1.341 0.233 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -52.7 -55.15 12.61 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 171.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.41 -49.63 14.95 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.654 0.661 . . . . 0.0 112.04 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.16 -54.37 46.65 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.118 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.24 82.69 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.705 0.802 . . . . 0.0 111.454 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.2 mmm -51.21 -46.13 62.12 Favored 'General case' 0 C--N 1.333 -0.112 0 C-N-CA 125.241 1.416 . . . . 0.0 109.54 169.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -58.1 5.12 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 125.317 1.436 . . . . 0.0 111.882 168.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.45 -50.03 75.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.526 0.33 . . . . 0.0 111.307 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -65.54 -49.41 69.01 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.273 0.488 . . . . 0.0 111.75 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -132.43 -55.42 0.96 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.193 0.997 . . . . 0.0 111.318 -169.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.98 142.26 3.37 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 108.531 -1.827 . . . . 0.0 108.531 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -81.14 74.8 8.13 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.142 0.971 . . . . 0.0 109.397 -174.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -98.02 26.09 5.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.148 167.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -141.99 42.71 1.69 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.27 -0.893 . . . . 0.0 110.073 -168.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.5 m -79.33 173.58 12.44 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -46.88 -44.45 19.63 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.646 0.778 . . . . 0.0 111.834 -171.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 p -48.84 -66.58 0.38 Allowed 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.206 1.402 . . . . 0.0 112.015 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -69.24 -40.7 77.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.714 0.806 . . . . 0.0 111.513 -173.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -61.39 -44.33 98.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.755 -0.591 . . . . 0.0 110.238 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 56.4 m -58.67 -45.06 90.23 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.014 -0.428 . . . . 0.0 110.621 170.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -40.24 66.67 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.541 0.736 . . . . 0.0 111.316 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 67' ' ' LEU . 47.7 t80 -66.41 -60.36 2.83 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.311 1.045 . . . . 0.0 110.911 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -62.29 -26.37 68.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.02 8.13 34.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.858 0.863 . . . . 0.0 111.807 172.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp 43.64 36.38 1.23 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 126.752 2.021 . . . . 0.0 113.089 -178.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 -32.59 59.37 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.8 mt -57.76 -14.66 6.16 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.527 0.731 . . . . 0.0 112.183 168.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.2 m 72.58 -65.97 0.33 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.893 1.677 . . . . 0.0 113.728 168.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -169.26 -52.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.465 0.706 . . . . 0.0 110.443 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -37.62 -57.21 0.98 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.256 1.823 . . . . 0.0 113.295 -173.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -81.97 -43.64 17.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.676 0.751 . . . . 0.0 110.159 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 58.7 mtp -43.53 -42.51 5.01 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 125.023 1.329 . . . . 0.0 112.388 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.1 t -63.06 -21.55 66.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -90.7 -47.2 7.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.098 0.959 . . . . 0.0 109.487 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.64 -52.47 6.36 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.202 1.801 . . . . 0.0 110.371 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -61.47 -57.95 21.83 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 117.493 -1.241 . . . . 0.0 112.096 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -44.27 -49.27 8.96 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.43 2.087 . . . . 0.0 112.295 170.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 mp -60.53 -50.44 73.53 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 -172.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.413 HD12 ' CE2' ' A' ' 50' ' ' PHE . 7.4 mt -64.64 -35.62 81.61 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.07 0.548 . . . . 0.0 111.985 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -62.26 -48.65 78.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -58.25 -46.89 85.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.405 173.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -52.07 -50.21 61.99 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.432 0.56 . . . . 0.0 111.047 175.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -42.26 89.8 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.844 0.458 . . . . 0.0 109.825 -173.002 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -53.46 -58.98 5.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.125 0.488 . . . . 0.0 109.879 170.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -58.91 -47.5 84.77 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.264 0.626 . . . . 0.0 110.404 -171.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.6 31.22 1.06 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.794 1.238 . . . . 0.0 111.543 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 . . . . . 0 CA--C 1.531 0.214 0 C-N-CA 123.665 0.786 . . . . 0.0 111.02 -178.033 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.532 0.273 0 CA-C-O 120.289 0.09 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.0 mp -42.76 -54.15 4.22 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.398 1.479 . . . . 0.0 111.609 -170.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -51.08 -46.99 61.95 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.597 1.159 . . . . 0.0 111.169 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.2 mp0 -69.33 -43.98 72.6 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.32 -51.47 45.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.79 1.636 . . . . 0.0 112.098 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -56.49 21.35 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.978 0.894 . . . . 0.0 109.637 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -52.31 -53.96 37.64 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.396 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -51.15 -53.11 37.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.65 1.18 . . . . 0.0 111.003 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.4 -48.09 81.79 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.908 0.483 . . . . 0.0 110.463 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.34 -37.29 86.69 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.145 0.498 . . . . 0.0 111.521 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.4 m -65.71 -36.68 84.32 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 121.81 -0.557 . . . . 0.0 109.884 176.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -56.73 -45.1 82.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.393 0.542 . . . . 0.0 111.142 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -59.47 -49.14 78.94 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.036 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -59.28 -46.94 87.18 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.881 -0.512 . . . . 0.0 110.519 -177.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -63.41 -45.01 92.97 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.492 0.717 . . . . 0.0 110.319 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -54.24 -48.24 71.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.506 0.722 . . . . 0.0 110.246 174.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.3 mt -61.9 -40.69 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.051 0.54 . . . . 0.0 109.82 177.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -61.04 -43.17 99.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.446 0.567 . . . . 0.0 111.26 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.27 -37.89 84.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.456 0.571 . . . . 0.0 110.244 170.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.37 35.72 9.32 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 124.637 1.113 . . . . 0.0 110.323 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -103.9 129.81 51.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.477 0.656 . . . . 0.0 109.876 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.5 p -73.07 160.03 32.68 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.148 0.579 . . . . 0.0 110.491 -175.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -72.76 68.1 0.84 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 167.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.96 -58.11 0.11 Allowed Glycine 0 CA--C 1.524 0.646 0 N-CA-C 106.664 -2.574 . . . . 0.0 106.664 -169.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.32 -50.08 74.06 Favored 'General case' 0 C--N 1.34 0.152 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 169.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 70.6 t -55.53 -43.16 71.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 174.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.66 -51.0 51.47 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.71 -52.9 63.5 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.61 0.764 . . . . 0.0 110.292 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.13 74.06 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.711 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -44.85 92.25 Favored 'General case' 0 C--O 1.224 -0.255 0 O-C-N 121.842 -0.536 . . . . 0.0 110.196 175.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.5 -54.29 5.68 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 124.827 1.203 . . . . 0.0 111.374 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -62.56 -50.99 69.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.638 0.375 . . . . 0.0 111.577 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.28 -25.49 36.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -169.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -142.81 -60.74 0.43 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.572 1.149 . . . . 0.0 110.782 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 154.05 139.34 2.82 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 107.021 -2.431 . . . . 0.0 107.021 -169.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -82.24 69.42 8.97 Favored 'General case' 0 C--N 1.337 0.044 0 CA-C-N 118.481 1.141 . . . . 0.0 110.376 -170.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -92.44 35.18 1.02 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.01 0.524 . . . . 0.0 110.441 170.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -134.43 -52.8 0.83 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 121.506 -0.746 . . . . 0.0 111.771 -167.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p 30.36 -98.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.267 2.227 . . . . 0.0 112.567 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tm0? -125.23 -59.96 1.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.807 1.643 . . . . 0.0 108.831 172.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.45 -58.31 7.96 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 123.937 0.895 . . . . 0.0 112.755 -167.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -41.64 99.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.729 0.695 . . . . 0.0 111.342 -177.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -57.59 -47.43 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.964 0.802 . . . . 0.0 110.871 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -63.05 -45.97 89.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.961 -0.462 . . . . 0.0 110.17 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -59.2 -40.43 85.75 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.629 0.772 . . . . 0.0 111.485 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -60.52 -55.46 33.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.153 0.581 . . . . 0.0 109.945 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -59.43 -39.22 82.83 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.645 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.09 -5.85 38.27 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 173.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.9 mt 58.52 42.39 21.0 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.707 2.003 . . . . 0.0 111.825 176.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -79.79 -31.51 40.81 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.846 0.858 . . . . 0.0 111.805 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.55 31.05 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.949 1.462 . . . . 0.0 114.949 -168.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 92.3 p 55.06 -80.54 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.515 2.326 . . . . 0.0 113.595 -178.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -174.74 -38.89 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.612 2.365 . . . . 0.0 109.335 -176.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -44.89 -52.18 8.88 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.616 1.166 . . . . 0.0 112.738 -174.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -76.73 -47.09 22.89 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.7 mtt -41.49 -46.9 3.61 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 125.184 1.394 . . . . 0.0 112.334 -177.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.5 t -61.42 -27.52 68.61 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -82.64 -51.19 7.97 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -45.1 -46.32 11.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.884 2.074 . . . . 0.0 111.799 -176.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -64.26 -64.02 3.23 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.99 -174.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.56 -37.46 96.99 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.476 1.451 . . . . 0.0 111.081 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.98 -56.93 12.31 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.231 0.612 . . . . 0.0 111.027 175.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.9 mt -67.88 -35.56 78.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.103 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.22 -49.75 75.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.834 0.743 . . . . 0.0 109.96 176.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -66.99 -42.01 85.78 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -52.21 -47.55 65.55 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 122.011 -0.43 . . . . 0.0 110.459 170.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -53.42 57.43 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -45.62 -53.56 9.01 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.89 0.876 . . . . 0.0 110.427 174.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.84 -45.71 91.33 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.79 -177.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.63 -51.17 66.41 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.736 0.814 . . . . 0.0 111.134 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 N--CA 1.454 -0.233 0 O-C-N 122.122 -0.361 . . . . 0.0 110.071 -177.126 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 CA--C 1.53 0.195 0 CA-C-O 119.531 -0.271 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -53.97 -36.47 62.9 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.388 0.675 . . . . 0.0 112.558 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -79.87 -49.12 12.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.553 0.615 . . . . 0.0 109.443 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -51.78 -48.85 63.62 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.843 -0.599 . . . . 0.0 111.786 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -55.95 -62.71 1.52 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 118.801 0.728 . . . . 0.0 111.43 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -59.06 -43.62 91.73 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.612 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -56.0 -52.36 64.5 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 110.196 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -52.3 66.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.142 0.977 . . . . 0.0 110.327 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.66 -48.86 63.25 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.81 0.844 . . . . 0.0 109.884 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.6 m -62.29 -45.82 91.54 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.057 0.543 . . . . 0.0 110.64 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -54.91 -45.95 74.81 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.105 0.562 . . . . 0.0 109.568 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.9 -46.14 85.39 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.03 -0.419 . . . . 0.0 111.258 174.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -59.16 -46.79 87.46 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.248 0.931 . . . . 0.0 110.567 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -58.89 -46.45 87.82 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 122.184 -0.322 . . . . 0.0 110.518 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -55.17 -47.12 75.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.544 0.738 . . . . 0.0 110.948 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 81.9 mt -59.54 -46.96 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 123.109 0.563 . . . . 0.0 109.773 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -57.77 -42.02 83.21 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.468 0.576 . . . . 0.0 111.224 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.47 -15.66 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.24 33.04 72.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 -173.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 122.634 1.207 . . . . 0.0 109.091 -174.921 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t0 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 120.504 0.192 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.1 t -50.81 -50.44 23.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.267 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.83 -44.74 55.62 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.452 0.549 . . . . 0.0 112.389 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.41 -52.1 59.86 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 123.819 0.847 . . . . 0.0 110.396 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.33 -57.42 12.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.437 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 10.5 ttm -50.32 -42.49 52.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.546 1.138 . . . . 0.0 111.293 169.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.55 -54.28 6.61 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 124.721 1.153 . . . . 0.0 111.875 170.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -67.19 -49.08 65.92 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.61 0.364 . . . . 0.0 111.459 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.6 mt -71.66 -53.44 13.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.479 0.712 . . . . 0.0 112.49 -169.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -116.45 -58.18 2.11 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.836 1.654 . . . . 0.0 111.142 -169.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.35 152.38 7.61 Favored Glycine 0 CA--C 1.532 1.122 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 -171.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.63 60.91 1.73 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.283 1.433 . . . . 0.0 113.216 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -110.36 174.32 5.92 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.768 1.227 . . . . 0.0 108.029 172.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' HG12 ' A' ' 47' ' ' ILE . 74.9 m-85 66.7 39.88 3.46 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.379 1.072 . . . . 0.0 112.302 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -74.85 57.65 0.79 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.565 1.546 . . . . 0.0 109.855 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 72.53 -53.03 0.7 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.361 1.465 . . . . 0.0 111.25 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -41.66 -70.8 0.1 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 127.761 2.424 . . . . 0.0 111.715 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.96 -32.83 74.24 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.259 0.624 . . . . 0.0 111.461 -171.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.41 HG12 ' HB3' ' A' ' 42' ' ' PHE . 18.2 mm -60.52 -53.56 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 171.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -53.94 -48.37 70.31 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.999 -0.438 . . . . 0.0 110.535 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -56.71 -42.83 79.87 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.498 175.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -57.85 -55.52 33.8 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.876 0.47 . . . . 0.0 110.311 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -57.13 -38.03 72.87 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.551 176.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.28 -1.36 26.21 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.7 mp 51.26 30.58 5.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.231 1.813 . . . . 0.0 112.988 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -83.9 35.22 0.52 Allowed 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.897 -1.127 . . . . 0.0 111.004 -174.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.7 mt -139.86 19.66 2.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.666 1.586 . . . . 0.0 110.513 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.0 m 28.64 60.84 0.13 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.336 2.655 . . . . 0.0 116.029 169.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.2 t80 68.89 -58.59 0.49 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.51 1.924 . . . . 0.0 114.417 171.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -41.3 -56.0 2.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 113.262 -170.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -76.69 -49.69 15.5 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.565 0.698 . . . . 0.0 109.365 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 89.0 mtp -45.12 -44.8 10.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.602 1.561 . . . . 0.0 112.847 -173.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.9 t -59.77 -35.67 75.11 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.9 0.48 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.5 mttp -79.38 -35.97 39.92 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.644 0.778 . . . . 0.0 110.066 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.42 ' C ' HD12 ' A' ' 63' ' ' LEU 0.266 0.0 OUTLIER -65.32 -45.3 84.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.074 0.95 . . . . 0.0 112.132 -178.087 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -44.67 -62.25 1.7 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.212 1.005 . . . . 0.0 113.434 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -60.28 -34.53 93.66 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 121.974 1.783 . . . . 0.0 112.33 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.1 -48.28 80.87 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 mt -64.24 -38.76 92.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 118.108 0.413 . . . . 0.0 111.507 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.09 -51.62 69.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.91 0.777 . . . . 0.0 109.881 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -60.93 -39.06 87.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.545 0.338 . . . . 0.0 110.162 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -56.98 -44.8 83.06 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 121.761 -0.587 . . . . 0.0 109.916 173.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -47.32 86.36 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.921 0.888 . . . . 0.0 109.426 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.96 -46.65 78.53 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.974 0.509 . . . . 0.0 110.915 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -67.37 -51.2 54.99 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.568 1.147 . . . . 0.0 112.204 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 128.29 2.636 . . . . 0.0 113.959 -174.348 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -47.74 -40.6 20.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.66 0.784 . . . . 0.0 111.98 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.35 -43.84 93.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.893 -0.505 . . . . 0.0 109.806 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.98 -49.1 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.426 1.09 . . . . 0.0 110.328 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -54.6 44.55 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.145 0.884 . . . . 0.0 110.882 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -55.14 -51.05 67.7 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -54.88 -49.7 70.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.882 0.473 . . . . 0.0 110.974 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.9 -51.35 67.91 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 110.651 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -62.59 -42.7 99.72 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.936 -0.477 . . . . 0.0 110.725 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.8 m -61.02 -44.94 96.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.174 0.589 . . . . 0.0 110.258 176.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -55.71 -48.33 75.34 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.811 1.244 . . . . 0.0 109.042 176.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -55.31 -45.13 76.33 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.183 173.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -59.18 -49.43 77.88 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.226 0.921 . . . . 0.0 110.645 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -55.29 -47.01 76.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.012 -0.43 . . . . 0.0 110.694 176.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.3 ttp85 -57.8 -45.05 86.65 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 110.949 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.9 mt -61.99 -46.75 95.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 C-N-CA 123.385 0.674 . . . . 0.0 109.822 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.28 -41.01 78.93 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.801 0.728 . . . . 0.0 110.848 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.99 -13.43 62.45 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 173.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.54 29.37 72.91 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 123.891 0.758 . . . . 0.0 111.286 -177.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 . . . . . 0 N--CA 1.455 -0.212 0 CA-C-N 117.448 0.624 . . . . 0.0 109.821 -177.966 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.67 -40.4 79.23 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-O 118.622 -0.704 . . . . 0.0 109.339 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.15 -57.44 6.3 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 174.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.4 tp -60.71 -43.27 98.04 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.561 0.744 . . . . 0.0 109.725 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.574 ' HB1' ' HE1' ' A' ' 70' ' ' TRP . . . -59.52 -37.51 78.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.381 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 31.2 mmm -65.99 -45.98 79.65 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -38.38 -51.05 2.33 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 126.813 2.149 . . . . 0.0 111.919 172.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -57.43 -40.31 78.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.0 mt -99.5 -53.87 3.09 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.671 0.388 . . . . 0.0 111.547 -169.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -112.58 -48.68 2.99 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.709 1.604 . . . . 0.0 110.908 -169.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.02 155.59 6.48 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 108.681 -1.768 . . . . 0.0 108.681 -169.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -76.96 68.27 3.1 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.119 0.96 . . . . 0.0 110.273 -173.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -85.2 -58.45 2.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.346 0.658 . . . . 0.0 109.714 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -93.27 89.84 6.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.999 -0.438 . . . . 0.0 111.868 -168.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 m -100.34 -179.24 4.06 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 169.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -51.25 -36.28 41.17 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.7 p -53.04 -73.59 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.795 0.838 . . . . 0.0 109.82 172.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -43.33 65.74 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.547 1.139 . . . . 0.0 111.807 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.77 -48.04 81.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 O-C-N 121.504 -0.747 . . . . 0.0 111.47 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.7 p -56.01 -45.14 79.17 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.395 -1.441 . . . . 0.0 110.201 174.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -37.07 75.28 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.961 0.504 . . . . 0.0 111.915 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -58.88 -55.45 34.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.139 0.976 . . . . 0.0 110.012 173.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.15 -27.94 69.72 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.12 -4.34 56.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.5 0.72 . . . . 0.0 112.436 171.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp 53.96 31.44 13.47 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.071 2.148 . . . . 0.0 113.996 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -92.25 27.64 2.15 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.538 -0.726 . . . . 0.0 111.494 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 mt -128.85 31.06 5.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.901 1.68 . . . . 0.0 107.887 170.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 m -33.73 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 129.913 3.285 . . . . 0.0 114.704 -168.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 23.0 t80 68.65 -58.24 0.48 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.745 2.418 . . . . 0.0 113.323 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -43.14 -51.71 5.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.902 1.681 . . . . 0.0 113.074 -172.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -81.55 -48.32 11.95 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.9 mtt -43.84 -40.41 4.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 126.195 1.798 . . . . 0.0 112.761 -173.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.7 t -66.94 -23.37 65.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.085 -1.046 . . . . 0.0 113.063 -176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.62 -55.22 3.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.905 0.86 . . . . 0.0 108.701 169.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -48.02 -44.23 30.78 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.109 2.164 . . . . 0.0 112.294 -177.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -63.64 -62.95 4.53 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.436 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.55 -37.01 96.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.205 1.27 . . . . 0.0 111.881 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.0 -49.91 72.83 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.0 mt -61.88 -40.34 95.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.312 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -57.0 -53.7 55.12 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.78 0.718 . . . . 0.0 109.795 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -58.93 -46.02 88.98 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.679 0.392 . . . . 0.0 110.438 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.574 ' HE1' ' HB1' ' A' ' 33' ' ' ALA . 73.4 t90 -54.56 -45.09 73.42 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.479 0.312 . . . . 0.0 110.639 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.83 -44.44 85.55 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.01 -40.05 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.768 0.427 . . . . 0.0 110.503 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.69 -59.47 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.17 0.588 . . . . 0.0 111.488 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.174 0 C-N-CA 124.266 1.026 . . . . 0.0 112.563 -169.4 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 N--CA 1.455 -0.19 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -53.86 -47.51 70.95 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.587 0.355 . . . . 0.0 110.967 173.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -65.55 -43.35 90.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.501 0.721 . . . . 0.0 110.053 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.14 -47.09 81.99 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.737 0.415 . . . . 0.0 110.404 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -56.63 18.96 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.546 0.738 . . . . 0.0 110.298 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -52.27 -54.18 34.51 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.738 0.815 . . . . 0.0 109.077 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -54.95 -49.92 70.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.634 0.774 . . . . 0.0 111.055 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.51 -52.97 60.28 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.159 0.89 . . . . 0.0 110.814 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -60.32 -38.69 84.49 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.49 -0.757 . . . . 0.0 111.132 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 85.7 m -65.2 -44.63 87.73 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.552 -0.717 . . . . 0.0 109.829 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -53.07 -54.06 41.05 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.807 1.243 . . . . 0.0 108.865 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.43 -52.33 62.12 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 177.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -56.65 -54.29 47.74 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.934 -0.479 . . . . 0.0 111.367 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -57.25 -48.32 79.16 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 122.094 -0.379 . . . . 0.0 110.528 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.7 ttp85 -50.79 -50.42 56.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.766 0.826 . . . . 0.0 110.569 176.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.78 -49.26 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 C-N-CA 122.979 0.512 . . . . 0.0 110.023 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -55.48 -42.41 74.32 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.82 0.737 . . . . 0.0 111.239 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.5 mt -68.54 -17.87 64.24 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.377 0.671 . . . . 0.0 112.075 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.93 25.7 75.16 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 122.096 0.95 . . . . 0.0 108.46 -176.739 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.5 t70 . . . . . 0 CA--C 1.529 0.146 0 N-CA-C 110.566 -0.161 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.87 -56.31 13.31 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.56 -48.77 34.74 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 123.811 0.72 . . . . 0.0 111.746 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.62 -54.86 29.22 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.451 0.643 . . . . 0.0 110.933 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.63 -48.97 77.98 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.964 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -40.3 81.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.471 0.708 . . . . 0.0 110.413 174.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -46.88 -55.89 8.0 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 125.004 1.287 . . . . 0.0 111.112 169.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -61.42 -48.22 82.17 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -80.99 -28.93 35.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -145.16 -63.53 0.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 111.049 -172.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.87 140.52 3.34 Favored Glycine 0 CA--C 1.529 0.945 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 -169.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.28 61.06 5.31 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 122.112 -0.64 . . . . 0.0 111.351 -168.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -81.64 -151.86 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 64.4 31.9 12.35 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.422 -0.799 . . . . 0.0 112.085 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -76.77 54.2 0.97 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.078 1.751 . . . . 0.0 110.235 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 66.39 -67.36 0.15 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.983 1.713 . . . . 0.0 109.99 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.2 p -28.45 -73.4 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 128.16 2.584 . . . . 0.0 111.838 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.8 m -53.49 -37.85 63.12 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.373 1.869 . . . . 0.0 112.714 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -75.02 -48.96 30.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 121.631 -0.668 . . . . 0.0 109.829 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.9 m -53.95 -48.77 69.94 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.587 -0.696 . . . . 0.0 110.652 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -58.52 -40.76 83.79 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.522 1.129 . . . . 0.0 110.936 176.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.461 ' CE2' HD12 ' A' ' 67' ' ' LEU . 4.2 t80 -57.56 -56.62 19.57 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.311 0.505 . . . . 0.0 110.31 175.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -65.55 -25.28 67.36 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.71 -5.13 44.17 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.058 0.845 . . . . 0.0 112.083 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 50.03 42.39 24.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.508 1.923 . . . . 0.0 111.552 -171.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -79.86 -34.68 39.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.78 0.832 . . . . 0.0 112.005 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.38 52.11 1.55 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.899 0.88 . . . . 0.0 111.931 -169.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 m -24.17 85.43 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.515 3.126 . . . . 0.0 116.757 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 t80 68.43 -57.76 0.48 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.759 2.424 . . . . 0.0 114.224 170.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -43.32 -50.98 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.198 1.799 . . . . 0.0 112.358 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -46.54 22.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.413 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 62.6 mtt -46.81 -44.91 19.68 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.913 1.285 . . . . 0.0 112.136 -172.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 22.2 t -64.39 -22.18 66.87 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -175.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.3 -51.91 5.32 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.063 0.935 . . . . 0.0 108.607 171.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 60' ' ' MET . 28.3 tp -47.1 -45.49 22.17 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 127.669 2.388 . . . . 0.0 112.041 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -63.66 -64.14 3.22 Favored Pre-proline 0 N--CA 1.453 -0.286 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.371 -176.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -56.28 -39.46 91.13 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 CA-C-N 120.87 1.346 . . . . 0.0 111.202 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tt -53.66 -57.7 9.85 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 123.005 0.522 . . . . 0.0 111.563 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 50' ' ' PHE . 83.2 mt -70.75 -31.18 67.91 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.151 0.58 . . . . 0.0 110.958 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.84 -46.17 89.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.73 -41.91 91.65 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.131 -0.356 . . . . 0.0 110.116 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -52.53 -46.73 66.85 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.156 0.434 . . . . 0.0 110.325 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.45 -46.78 86.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.11 -52.17 53.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.806 0.275 . . . . 0.0 110.638 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.79 -54.46 46.87 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.782 0.433 . . . . 0.0 111.709 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.272 0 C-N-CA 124.64 1.176 . . . . 0.0 111.652 -173.458 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 119.719 -0.182 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.31 -54.23 47.89 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.764 0.426 . . . . 0.0 109.966 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.97 -44.32 91.49 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.347 0.659 . . . . 0.0 110.95 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -57.93 -48.07 81.01 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.713 0.405 . . . . 0.0 110.712 176.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -55.84 29.79 Favored 'General case' 0 C--N 1.337 0.05 0 C-N-CA 123.134 0.574 . . . . 0.0 109.658 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -54.23 -51.91 63.0 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.67 0.388 . . . . 0.0 110.262 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -54.43 -53.76 49.89 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.452 0.701 . . . . 0.0 110.688 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.91 92.03 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.756 0.422 . . . . 0.0 111.114 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.5 ttpm? -56.36 -45.43 80.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.766 0.826 . . . . 0.0 109.798 174.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.3 m -63.57 -42.03 98.34 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.064 -0.397 . . . . 0.0 110.808 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -55.46 -51.1 68.06 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.35 -51.91 66.54 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.958 0.503 . . . . 0.0 110.85 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -45.97 88.73 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.745 -0.597 . . . . 0.0 110.421 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -65.98 -45.84 80.22 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.797 0.439 . . . . 0.0 109.848 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.4 ttp85 -50.58 -51.81 44.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 109.988 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 88.3 mt -59.42 -48.54 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.5 -42.46 78.38 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.4 0.546 . . . . 0.0 111.372 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.59 -16.23 63.79 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.7 0.8 . . . . 0.0 111.722 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.7 28.44 73.76 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -176.11 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 119.938 -0.077 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.09 -48.38 89.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -176.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.92 -52.74 24.99 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 118.744 0.702 . . . . 0.0 111.659 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.11 -56.36 21.72 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.843 0.857 . . . . 0.0 110.46 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.73 -45.77 91.16 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.018 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mmm -55.51 -45.99 77.02 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 121.814 -0.554 . . . . 0.0 110.053 170.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.44 -57.08 4.55 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.754 1.168 . . . . 0.0 111.794 169.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -59.25 -50.5 73.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.787 0.293 . . . . 0.0 111.344 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.8 mt -78.14 -29.5 48.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -171.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -146.24 -61.4 0.31 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.127 0.971 . . . . 0.0 111.456 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 164.96 138.7 2.47 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 107.616 -2.193 . . . . 0.0 107.616 -169.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -78.73 38.87 0.33 Allowed 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.665 -0.903 . . . . 0.0 113.268 -168.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -81.38 41.75 0.63 Allowed 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.289 -0.882 . . . . 0.0 111.362 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -147.45 33.81 0.87 Allowed 'General case' 0 CA--C 1.524 -0.033 0 C-N-CA 124.094 0.958 . . . . 0.0 109.971 -169.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.6 m -73.07 64.58 0.73 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.814 1.246 . . . . 0.0 110.266 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 68.96 -60.56 0.45 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.413 1.885 . . . . 0.0 111.972 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 m -45.12 -66.3 0.42 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.9 1.28 . . . . 0.0 111.797 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.49 -41.07 69.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.267 1.027 . . . . 0.0 111.729 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.7 mm -64.73 -43.79 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.483 0.713 . . . . 0.0 109.991 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.6 p -65.42 -43.34 90.84 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.751 -0.593 . . . . 0.0 110.731 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -58.88 -45.94 89.02 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 118.51 0.596 . . . . 0.0 109.707 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -55.73 -57.95 9.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.254 1.022 . . . . 0.0 110.327 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -62.19 -34.99 77.5 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 -3.86 30.06 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 172.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 59.1 28.78 18.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.953 1.701 . . . . 0.0 111.926 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.35 -34.69 58.94 Favored 'General case' 0 C--N 1.333 -0.125 0 O-C-N 121.133 -0.98 . . . . 0.0 109.002 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 68.5 mt -62.98 -5.05 2.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 112.388 170.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.0 m 69.91 -65.16 0.32 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.722 1.609 . . . . 0.0 115.18 166.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -166.18 -53.28 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.826 0.739 . . . . 0.0 111.489 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -46.37 -51.54 14.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.924 0.889 . . . . 0.0 113.202 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -77.73 -52.15 9.4 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.6 mmm -38.04 -51.22 1.38 Allowed 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 126.338 1.855 . . . . 0.0 111.267 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 31.3 t -65.8 -29.28 69.74 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -84.63 -40.39 17.52 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.975 0.893 . . . . 0.0 108.978 175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -67.74 -35.02 77.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.844 1.257 . . . . 0.0 113.584 -176.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -50.33 -67.39 0.47 Allowed Pre-proline 0 CA--C 1.536 0.406 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.885 173.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -57.75 -37.03 98.01 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.907 1.738 . . . . 0.0 111.394 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tt -53.6 -55.38 26.27 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.611 0.764 . . . . 0.0 111.117 173.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.3 mt -66.71 -31.9 72.86 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.781 -0.574 . . . . 0.0 112.02 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.09 -47.71 78.98 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.573 -0.704 . . . . 0.0 109.254 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -64.2 -39.98 95.12 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 119.245 -0.407 . . . . 0.0 110.608 175.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 68.8 t90 -52.42 -49.1 65.21 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.459 0.572 . . . . 0.0 110.181 169.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.72 -47.48 85.07 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -175.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.81 -53.27 50.94 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.823 0.449 . . . . 0.0 110.69 175.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.82 -50.09 75.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.674 0.39 . . . . 0.0 111.41 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.238 0 C-N-CA 124.903 1.281 . . . . 0.0 111.449 -175.693 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mp . . . . . 0 CA--C 1.53 0.196 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -52.48 -40.6 62.51 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.935 0.894 . . . . 0.0 111.902 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -70.58 -54.37 12.32 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.5 mt -52.25 -52.96 49.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 112.102 -171.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.18 -59.73 4.28 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.57 0.7 . . . . 0.0 111.588 -174.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -53.24 -60.22 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.411 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -50.6 -50.19 54.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.187 0.995 . . . . 0.0 111.35 -172.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.32 -53.24 60.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.556 0.693 . . . . 0.0 110.476 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -65.49 -22.74 66.76 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.66 -0.65 . . . . 0.0 111.542 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 57.6 m -75.96 -40.38 54.08 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.366 -0.834 . . . . 0.0 109.455 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.62 -48.44 72.21 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 170.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.2 tttp -54.38 -55.65 26.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.699 0.285 . . . . 0.0 111.671 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -57.41 -52.07 66.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.746 -0.596 . . . . 0.0 111.218 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpt85 -60.26 -44.67 95.08 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.161 0.584 . . . . 0.0 110.421 -178.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 58.9 ttp85 -52.72 -49.41 65.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.073 0.949 . . . . 0.0 110.482 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 75.1 mt -59.66 -46.87 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-O 119.128 -0.463 . . . . 0.0 110.059 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -57.02 -42.12 79.82 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.085 0.857 . . . . 0.0 111.299 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.24 -18.42 65.34 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.741 0.416 . . . . 0.0 112.086 174.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.09 24.43 74.6 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 -172.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 122.609 1.195 . . . . 0.0 108.492 -175.667 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t70 . . . . . 0 C--O 1.232 0.181 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.4 t -57.74 -52.43 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.22 -48.51 47.0 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.39 -56.92 15.19 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 117.494 0.647 . . . . 0.0 110.167 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.401 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.03 -46.22 90.22 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.894 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -47.02 60.99 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.957 1.303 . . . . 0.0 109.41 170.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -48.8 -59.15 6.95 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.943 1.259 . . . . 0.0 112.307 169.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.25 -47.81 77.79 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 117.06 0.43 . . . . 0.0 111.409 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.1 mt -73.5 -50.35 21.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 5.9 m-85 -126.3 -59.05 1.33 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.938 0.895 . . . . 0.0 112.0 -168.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 158.55 135.1 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -169.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -82.39 73.6 9.41 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.699 -0.883 . . . . 0.0 110.331 -170.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.79 27.67 2.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.311 167.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -148.13 47.17 1.07 Allowed 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.852 -0.53 . . . . 0.0 110.403 -167.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.2 p -60.04 -59.88 4.71 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.921 0.888 . . . . 0.0 109.154 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -159.29 -54.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.062 1.345 . . . . 0.0 109.029 -177.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.0 p -48.69 -69.74 0.11 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.414 1.485 . . . . 0.0 111.023 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.2 m -49.12 -49.14 43.48 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.22 1.408 . . . . 0.0 111.363 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.6 mm -60.21 -47.8 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.993 0.917 . . . . 0.0 110.533 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m -62.59 -48.19 80.54 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.205 -0.309 . . . . 0.0 110.475 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -36.88 82.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.284 0.634 . . . . 0.0 110.925 178.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -63.6 -52.28 61.61 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 118.671 0.669 . . . . 0.0 110.639 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -58.22 -33.25 69.11 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.661 0.784 . . . . 0.0 112.082 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.47 8.89 22.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.066 0.946 . . . . 0.0 112.373 172.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.5 mp 36.83 44.88 0.38 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.64 2.376 . . . . 0.0 113.459 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -85.52 -53.05 5.43 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.713 1.205 . . . . 0.0 108.955 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.87 101.61 0.22 Allowed 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.11 -179.89 1.36 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.053 1.741 . . . . 0.0 114.357 -167.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -40.53 -46.79 2.56 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.825 1.65 . . . . 0.0 113.906 -169.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -41.46 -46.16 3.37 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.249 1.42 . . . . 0.0 112.555 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -79.02 -58.43 3.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.69 0.796 . . . . 0.0 108.886 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 41.4 mtt -44.95 -49.89 10.86 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.785 1.234 . . . . 0.0 112.117 -170.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.4 t -66.19 -36.95 84.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.629 -169.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -74.01 -43.18 58.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.498 0.666 . . . . 0.0 109.677 172.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.3 tp -64.64 -46.5 82.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.864 0.866 . . . . 0.0 112.003 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -52.33 -56.55 21.27 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.961 -173.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.06 -36.51 89.07 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 CA-C-N 121.247 1.481 . . . . 0.0 111.824 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.407 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.4 mp -61.21 -52.08 66.29 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -63.14 -38.9 93.0 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.349 0.66 . . . . 0.0 111.341 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -58.74 -51.94 67.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -64.08 -40.05 95.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.282 -0.261 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.401 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 54.4 t90 -53.78 -46.72 71.11 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 172.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.64 -46.23 80.03 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.89 -51.81 59.82 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.016 0.526 . . . . 0.0 110.906 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -58.73 -50.95 72.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.359 0.664 . . . . 0.0 111.099 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 124.022 0.929 . . . . 0.0 111.382 -178.408 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -54.49 -36.98 64.74 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.053 -1.029 . . . . 0.0 109.49 168.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -61.96 -50.26 72.83 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.283 0.633 . . . . 0.0 109.741 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -55.69 -43.39 76.38 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 124.358 1.063 . . . . 0.0 109.688 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -55.48 22.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.592 0.757 . . . . 0.0 109.397 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -54.08 -56.23 20.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -50.63 -54.11 25.44 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.184 0.594 . . . . 0.0 110.992 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.74 -50.38 73.7 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.785 -0.572 . . . . 0.0 110.475 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -28.02 68.76 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.73 -0.606 . . . . 0.0 111.384 176.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 90.1 m -70.92 -45.47 64.19 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -55.04 -44.31 74.56 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.728 0.411 . . . . 0.0 110.08 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -55.97 -54.1 48.88 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.99 -0.444 . . . . 0.0 110.741 174.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -55.1 -46.33 75.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.995 -0.441 . . . . 0.0 111.002 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -53.44 -50.68 64.75 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.186 0.448 . . . . 0.0 110.298 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -54.34 -48.01 71.88 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.559 0.618 . . . . 0.0 111.658 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.39 -54.86 20.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.399 0.545 . . . . 0.0 109.724 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -55.52 -43.85 76.09 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.082 0.401 . . . . 0.0 111.148 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.05 -14.25 60.21 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.355 0.662 . . . . 0.0 112.279 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.16 34.88 87.53 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -173.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 . . . . . 0 C--O 1.234 0.269 0 CA-C-O 122.146 0.974 . . . . 0.0 110.182 -176.631 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.327 0.584 . . . . 0.0 109.654 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.7 t -50.39 -49.61 23.44 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.992 171.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.9 -46.33 32.11 Favored Glycine 0 CA--C 1.527 0.809 0 C-N-CA 123.816 0.722 . . . . 0.0 113.75 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.3 -50.89 68.3 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.28 1.04 . . . . 0.0 110.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.424 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.93 -52.42 65.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.158 -178.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -37.96 58.29 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.886 1.274 . . . . 0.0 109.772 169.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -49.72 -59.83 6.98 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 125.612 1.577 . . . . 0.0 111.16 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -62.84 -39.91 95.83 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.517 0.198 . . . . 0.0 111.306 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.0 tp -84.87 -23.91 28.77 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -168.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -148.96 -65.19 0.23 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.398 1.879 . . . . 0.0 110.601 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 177.27 139.95 3.49 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 -169.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.7 62.46 5.54 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 117.521 0.661 . . . . 0.0 112.355 -167.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -92.24 -155.04 0.4 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.44 40.44 20.76 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 120.843 -1.161 . . . . 0.0 113.894 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -75.51 50.48 0.54 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.092 1.357 . . . . 0.0 108.901 169.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 67.29 -42.28 0.43 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.182 1.793 . . . . 0.0 112.023 -167.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -42.26 -70.49 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.955 2.102 . . . . 0.0 113.216 -173.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 p -65.41 -40.46 93.41 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.54 -0.725 . . . . 0.0 110.409 -174.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.1 mm -54.37 -41.31 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.167 0.987 . . . . 0.0 110.712 173.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.5 m -68.62 -48.37 64.25 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.482 -0.761 . . . . 0.0 109.782 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -58.81 -33.65 70.62 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.756 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.18 -52.29 36.12 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 126.216 1.806 . . . . 0.0 110.531 174.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -60.6 -23.8 64.98 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.62 0.768 . . . . 0.0 112.455 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.03 -6.32 55.67 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 0.0 112.463 169.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.77 41.15 32.13 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 127.075 2.15 . . . . 0.0 112.095 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.29 -7.18 24.85 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.8 mt -83.73 50.53 1.82 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.753 1.16 . . . . 0.0 111.176 -175.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 42.62 31.23 0.28 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.897 2.879 . . . . 0.0 116.038 170.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 t80 67.84 -50.81 0.52 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.21 1.804 . . . . 0.0 113.019 -174.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -38.45 -53.46 1.54 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.593 1.957 . . . . 0.0 112.786 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.88 -49.02 19.09 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 mtp -47.78 -47.2 30.81 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.626 1.571 . . . . 0.0 110.699 -174.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.5 t -59.17 -34.37 72.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.688 0.795 . . . . 0.0 113.106 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -85.37 -36.03 21.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.007 0.908 . . . . 0.0 110.124 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -62.93 -38.74 92.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.223 1.009 . . . . 0.0 110.661 -178.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -53.04 -64.08 1.9 Allowed Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.797 176.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -58.46 -39.02 87.37 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.027 1.818 . . . . 0.0 111.679 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -53.18 -52.58 58.35 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.877 0.762 . . . . 0.0 111.182 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.8 mt -69.35 -36.52 76.95 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.706 -0.621 . . . . 0.0 111.99 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -57.56 -49.76 75.33 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.835 0.743 . . . . 0.0 109.045 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -63.74 -42.24 97.91 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.529 0.332 . . . . 0.0 110.137 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.424 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 71.5 t90 -52.84 -47.04 68.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.217 0.462 . . . . 0.0 110.585 170.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -51.12 70.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -47.53 74.33 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.044 0.538 . . . . 0.0 110.335 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -59.13 -52.88 63.8 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.437 0.695 . . . . 0.0 110.575 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.204 0 C-N-CA 123.219 0.607 . . . . 0.0 110.181 177.801 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 119.551 -0.261 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -48.99 -47.71 44.04 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.387 1.075 . . . . 0.0 110.855 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -57.53 -45.86 84.53 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.349 0.26 . . . . 0.0 110.988 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.53 -53.12 61.31 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 124.573 1.149 . . . . 0.0 110.832 -175.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -57.66 11.83 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.216 0.462 . . . . 0.0 110.581 -177.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -54.93 -49.48 71.22 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -55.44 -50.61 69.37 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.341 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.72 -51.9 64.16 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.348 0.976 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp -59.77 -38.38 81.69 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.0 m -64.9 -44.7 88.72 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 121.706 -0.622 . . . . 0.0 109.78 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.52 -48.76 68.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.736 1.214 . . . . 0.0 109.544 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.95 -45.49 92.46 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 174.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.11 -45.35 83.5 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.013 -1.054 . . . . 0.0 111.247 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -60.95 -44.58 97.07 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 121.547 -0.721 . . . . 0.0 110.576 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -50.09 -48.97 52.95 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.657 0.783 . . . . 0.0 110.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -61.25 -51.26 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 122.951 0.5 . . . . 0.0 110.047 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -56.44 -41.39 76.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.892 0.769 . . . . 0.0 112.228 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.88 -12.06 61.19 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.698 0.799 . . . . 0.0 111.752 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.79 33.39 87.12 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -173.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 CA--C 1.519 -0.245 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.829 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t0 . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 120.425 0.155 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -58.43 -52.22 61.92 Favored 'Isoleucine or valine' 0 C--N 1.342 0.244 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 172.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.96 -50.54 15.19 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 123.454 0.549 . . . . 0.0 111.885 174.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.7 tp -59.51 -57.57 12.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 117.723 0.762 . . . . 0.0 111.107 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.35 97.29 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.103 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.413 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 66.9 mmm -55.34 -44.1 75.6 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.762 -0.586 . . . . 0.0 110.052 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.76 -57.83 5.1 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 124.728 1.156 . . . . 0.0 111.299 169.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -57.44 -50.17 73.88 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 35.2 mt -83.37 -25.61 31.23 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -169.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -145.88 -61.37 0.33 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.55 1.14 . . . . 0.0 111.046 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 166.11 137.48 2.22 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 107.641 -2.184 . . . . 0.0 107.641 -169.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.07 36.44 0.23 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -167.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -83.33 38.51 0.61 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.096 -1.003 . . . . 0.0 111.414 -172.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -152.75 42.79 0.63 Allowed 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 124.377 1.071 . . . . 0.0 109.671 -169.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 p -56.2 -62.05 1.97 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 170.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -154.43 -47.64 0.09 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.474 1.11 . . . . 0.0 111.106 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -47.66 -67.07 0.31 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.969 1.308 . . . . 0.0 114.295 -169.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 12.5 p -56.79 -49.43 75.35 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.047 0.939 . . . . 0.0 110.341 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.4 mm -53.89 -47.74 63.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.753 1.221 . . . . 0.0 110.909 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.9 m -60.02 -48.17 82.81 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.226 -0.921 . . . . 0.0 110.121 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -59.11 -31.15 68.66 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.165 0.586 . . . . 0.0 111.298 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.62 -57.62 7.7 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 124.092 0.957 . . . . 0.0 110.051 174.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.33 -26.45 68.77 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.87 -6.92 59.24 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.665 0.666 . . . . 0.0 112.428 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.9 mp 48.03 49.39 17.26 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.706 2.003 . . . . 0.0 113.082 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.0 -32.1 27.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.657 0.783 . . . . 0.0 110.678 174.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 42.0 mt -81.18 46.17 0.9 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.825 0.85 . . . . 0.0 112.511 -168.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 m -21.93 85.35 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 129.28 3.032 . . . . 0.0 116.568 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.3 t80 69.25 -57.37 0.53 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.352 2.261 . . . . 0.0 114.025 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -46.09 -51.54 13.67 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.465 1.506 . . . . 0.0 112.519 -172.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -46.47 30.27 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtt -46.95 -44.37 19.93 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.944 1.298 . . . . 0.0 111.715 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.3 t -60.72 -29.82 69.59 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -84.49 -47.49 10.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.273 1.035 . . . . 0.0 109.245 172.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.1 -40.58 70.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.164 1.786 . . . . 0.0 111.764 -175.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -60.58 -66.9 1.25 Allowed Pre-proline 0 CA--C 1.536 0.414 0 CA-C-O 117.995 -1.003 . . . . 0.0 111.039 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.61 -40.14 80.35 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.193 1.929 . . . . 0.0 111.726 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.04 -57.02 11.79 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.255 0.622 . . . . 0.0 111.299 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.1 mt -69.53 -35.0 75.05 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -58.71 -49.81 76.22 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.996 0.816 . . . . 0.0 110.131 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -44.94 90.65 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.413 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 76.7 t90 -50.96 -48.82 60.92 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.165 -0.335 . . . . 0.0 110.843 172.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.19 -51.86 67.23 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.78 -46.01 74.36 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.768 0.427 . . . . 0.0 110.316 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.66 -53.08 61.82 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.113 0.565 . . . . 0.0 110.489 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.261 0 C-N-CA 123.227 0.611 . . . . 0.0 110.204 178.316 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp . . . . . 0 CA--C 1.533 0.314 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -45.46 -47.59 13.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.004 0.922 . . . . 0.0 111.255 174.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.41 -47.31 84.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -52.22 60.66 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.222 1.009 . . . . 0.0 111.572 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -53.35 57.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.511 1.051 . . . . 0.0 110.974 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -59.88 -40.88 90.21 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.881 -0.512 . . . . 0.0 110.93 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -54.4 -51.17 65.7 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 121.717 -0.614 . . . . 0.0 109.98 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.64 -46.89 77.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.728 0.694 . . . . 0.0 111.821 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.2 -40.91 82.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.311 0.576 . . . . 0.0 111.036 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.7 m -63.28 -43.85 96.73 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.49 -0.756 . . . . 0.0 109.668 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -60.94 -45.22 95.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.551 1.141 . . . . 0.0 110.174 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -49.14 -52.16 27.94 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.143 0.429 . . . . 0.0 110.262 170.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -59.83 -50.87 72.11 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.797 -0.564 . . . . 0.0 111.257 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -55.85 -48.83 74.82 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.559 0.618 . . . . 0.0 110.59 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.3 ttp85 -52.84 -47.61 67.62 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 110.61 176.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 67.2 mt -60.11 -46.58 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.116 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -58.2 -40.88 82.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.191 0.905 . . . . 0.0 111.276 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.23 -13.1 59.79 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.933 -0.479 . . . . 0.0 112.112 173.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.87 27.74 73.59 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -174.545 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 CA--C 1.535 0.399 0 CA-C-O 120.273 0.082 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.1 t -57.7 -45.34 86.75 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.96 -51.18 25.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 123.686 0.66 . . . . 0.0 112.226 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.54 -50.96 65.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.97 0.908 . . . . 0.0 110.85 -178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.63 79.06 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.534 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 66.3 mmm -55.13 -47.41 75.09 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.075 0.95 . . . . 0.0 110.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.57 -53.29 3.61 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.212 1.387 . . . . 0.0 111.472 170.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -66.08 -55.05 18.46 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -75.29 -34.58 61.32 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -168.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -133.32 -56.59 0.91 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.422 1.089 . . . . 0.0 110.864 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.67 152.54 6.93 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 107.609 -2.197 . . . . 0.0 107.609 -170.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.05 65.77 5.32 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.169 0.985 . . . . 0.0 111.71 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -92.04 177.91 6.03 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.99 -1.855 . . . . 0.0 105.99 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 70.81 21.35 5.18 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.041 0.937 . . . . 0.0 112.882 168.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.3 m -75.01 73.06 2.19 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 169.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 72.41 -69.62 0.18 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 126.517 1.927 . . . . 0.0 112.312 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -46.4 -60.41 2.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.834 1.254 . . . . 0.0 112.159 -168.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.5 m -60.5 -31.55 70.58 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.605 0.762 . . . . 0.0 112.595 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -73.89 -40.8 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 119.013 0.824 . . . . 0.0 109.626 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.0 t -58.94 -53.59 56.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 171.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -58.29 -42.64 87.04 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.486 0.715 . . . . 0.0 111.261 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.1 -62.36 1.68 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 124.294 1.038 . . . . 0.0 109.95 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -62.7 -35.89 81.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.507 -174.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.63 -8.68 44.29 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.43 40.08 27.6 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.998 1.319 . . . . 0.0 110.559 -173.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -79.8 -32.79 40.79 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.574 0.75 . . . . 0.0 110.361 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 mt -81.24 45.19 0.83 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.556 0.742 . . . . 0.0 110.828 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.6 m -15.54 77.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 130.311 3.444 . . . . 0.0 116.763 -169.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.0 t80 69.22 -57.11 0.53 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.501 1.92 . . . . 0.0 114.249 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -39.04 -55.61 1.55 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.712 2.005 . . . . 0.0 113.363 -174.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -73.85 -52.67 12.24 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 122.07 0.938 . . . . 0.0 108.601 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.8 mtp -48.37 -38.57 19.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.537 1.535 . . . . 0.0 113.593 -170.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.78 -30.39 71.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -83.14 -42.28 17.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.607 0.718 . . . . 0.0 109.459 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.262 0.1 OUTLIER -62.86 -37.94 88.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.608 0.763 . . . . 0.0 112.407 -172.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -54.6 -67.21 0.7 Allowed Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.959 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.45 -41.58 74.65 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.328 2.019 . . . . 0.0 111.421 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.468 ' C ' HD23 ' A' ' 66' ' ' LEU . 2.4 tt -50.26 -49.86 51.92 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.935 0.494 . . . . 0.0 111.274 171.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 67' ' ' LEU . 11.7 mt -67.65 -42.66 81.9 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 118.953 0.797 . . . . 0.0 111.77 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -55.52 -48.55 74.48 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -62.9 -44.78 95.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.762 0.425 . . . . 0.0 110.843 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -52.53 -49.41 64.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.429 0.559 . . . . 0.0 110.264 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.4 -47.78 77.88 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.986 0.914 . . . . 0.0 109.012 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -50.86 -56.75 10.77 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.134 0.492 . . . . 0.0 110.547 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -60.4 -42.96 97.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.52 0.728 . . . . 0.0 110.217 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.415 0 C-N-CA 124.133 0.973 . . . . 0.0 111.187 174.836 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 119.414 -0.327 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -57.06 -57.08 14.14 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.66 -38.81 92.52 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 119.717 -0.182 . . . . 0.0 111.297 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.8 mt -58.48 -44.79 89.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.073 173.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.88 -52.18 64.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.197 0.908 . . . . 0.0 108.932 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.46 -53.89 48.15 Favored 'General case' 0 CA--C 1.529 0.135 0 O-C-N 122.146 -0.346 . . . . 0.0 110.147 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -52.08 -49.13 64.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.945 1.298 . . . . 0.0 110.351 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.53 -51.87 68.05 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.309 0.644 . . . . 0.0 111.173 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -57.21 -45.77 83.53 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.721 0.772 . . . . 0.0 110.005 175.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 m -61.01 -31.51 71.13 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.73 -0.606 . . . . 0.0 110.164 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -62.24 -28.96 70.06 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.308 -0.87 . . . . 0.0 110.987 175.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -65.48 -50.54 64.97 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 121.406 -0.809 . . . . 0.0 110.016 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -58.65 -40.88 84.73 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.954 -0.466 . . . . 0.0 110.496 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.4 mtm180 -67.28 -43.49 81.65 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.401 0.68 . . . . 0.0 110.862 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 42.9 mtm180 -49.27 -55.56 12.27 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.08 0.855 . . . . 0.0 109.895 169.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.72 -50.77 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -54.54 -44.6 73.0 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.249 0.62 . . . . 0.0 111.48 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.0 -9.19 58.03 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.04 29.29 74.37 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.067 0.849 . . . . 0.0 111.124 -171.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 N--CA 1.455 -0.188 0 C-N-CA 124.591 1.156 . . . . 0.0 109.821 176.244 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 44.9 t0 . . . . . 0 CA--C 1.531 0.212 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.08 -48.47 78.92 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 171.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.67 -54.59 8.87 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.781 0.705 . . . . 0.0 111.423 173.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 tp -60.4 -54.85 40.69 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.645 0.778 . . . . 0.0 111.054 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.13 -47.14 84.21 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.758 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -43.6 83.79 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.84 -0.537 . . . . 0.0 109.962 173.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.93 -55.7 6.22 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.827 1.203 . . . . 0.0 111.35 169.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.26 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.8 mt -85.66 -25.02 26.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -169.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -143.88 -64.52 0.37 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.117 1.367 . . . . 0.0 110.72 -174.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.97 143.06 3.71 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -171.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.18 71.95 8.18 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -172.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -107.48 26.91 9.67 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.528 0.731 . . . . 0.0 111.865 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -142.75 21.95 1.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -169.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 59.2 m -68.85 84.88 0.32 Allowed 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 169.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.282 4.2 pm0 58.25 -62.89 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 129.507 3.123 . . . . 0.0 113.806 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.3 m -33.46 -70.72 0.07 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.092 2.557 . . . . 0.0 112.953 -175.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 m -59.27 -38.76 80.89 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.091 1.357 . . . . 0.0 112.408 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.38 -35.51 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 122.977 0.511 . . . . 0.0 110.086 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -65.94 -50.41 64.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -56.25 -36.9 69.07 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.745 0.818 . . . . 0.0 111.278 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -60.36 -59.53 5.25 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.865 0.866 . . . . 0.0 110.054 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -56.42 -41.17 75.93 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.499 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.36 -3.45 24.06 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . 0.289 0.6 OUTLIER 40.56 51.82 2.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 127.236 2.214 . . . . 0.0 113.175 -170.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -79.39 -43.79 22.73 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.384 1.074 . . . . 0.0 110.838 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -80.22 58.65 3.1 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.699 0.8 . . . . 0.0 110.623 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.1 m -27.56 91.97 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 129.262 3.025 . . . . 0.0 116.121 -171.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 53.2 t80 67.49 -58.68 0.42 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.252 2.221 . . . . 0.0 114.63 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -44.13 -50.55 8.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.571 1.548 . . . . 0.0 112.56 -173.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.4 -54.51 12.13 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.694 0.759 . . . . 0.0 109.287 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.02 -43.41 19.53 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.669 1.588 . . . . 0.0 112.478 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.46 -32.36 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -83.5 -44.02 15.15 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.721 0.772 . . . . 0.0 109.262 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.5 tp -57.42 -42.16 81.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.278 1.031 . . . . 0.0 112.099 -176.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -58.68 -61.51 7.55 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.41 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -58.95 -38.77 86.28 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.721 1.614 . . . . 0.0 111.251 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tt -53.14 -54.13 40.28 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.865 0.757 . . . . 0.0 111.402 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.79 -39.12 87.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.797 0.439 . . . . 0.0 111.333 177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -58.69 -47.35 84.81 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.547 0.612 . . . . 0.0 109.856 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -64.31 -45.69 86.85 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.09 0.556 . . . . 0.0 110.143 177.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -50.95 -48.02 60.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.645 0.26 . . . . 0.0 110.425 173.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -51.41 69.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.422 1.089 . . . . 0.0 109.426 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -45.69 77.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.99 -54.6 35.76 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -178.191 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 C--O 1.227 -0.127 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.77 -39.65 52.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.563 0.745 . . . . 0.0 111.687 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -79.52 -48.08 14.48 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -53.13 -46.99 69.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.462 0.705 . . . . 0.0 111.71 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.09 -60.06 4.15 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.069 0.85 . . . . 0.0 111.658 -176.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -48.29 -52.05 23.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.862 175.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -54.46 -51.23 65.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.034 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.23 -52.71 63.45 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.84 0.746 . . . . 0.0 110.69 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -57.04 -46.41 82.44 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.574 0.702 . . . . 0.0 110.711 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.5 m -60.56 -39.76 89.13 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 123.112 0.565 . . . . 0.0 110.274 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -58.62 -49.15 78.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.934 0.893 . . . . 0.0 109.196 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -56.49 -52.74 63.59 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 122.446 -0.159 . . . . 0.0 110.908 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -52.74 -53.48 47.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.779 0.432 . . . . 0.0 110.666 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -54.63 -54.01 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.77 0.828 . . . . 0.0 110.187 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.0 ptt85 -63.19 -36.8 84.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.987 -0.446 . . . . 0.0 110.985 -174.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 73.8 mt -55.2 -56.03 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 170.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -55.13 -41.31 71.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.131 0.423 . . . . 0.0 111.683 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.6 mt -73.1 -14.7 61.44 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.76 20.61 77.59 Favored Glycine 0 CA--C 1.533 1.157 0 O-C-N 121.343 -0.848 . . . . 0.0 111.368 -170.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 122.481 1.134 . . . . 0.0 109.272 -176.41 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 CA--C 1.53 0.174 0 CA-C-O 120.586 0.232 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 ' CZ2' ' A' ' 70' ' ' TRP . 94.0 t -58.23 -50.37 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -53.76 10.84 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 175.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.18 -52.82 52.62 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.545 0.738 . . . . 0.0 111.018 -174.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -58.82 -47.71 83.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.455 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.57 85.41 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 121.978 -0.451 . . . . 0.0 109.916 173.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.72 -56.55 4.97 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 125.218 1.39 . . . . 0.0 111.131 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -61.88 -51.77 66.83 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 87.5 mt -77.12 -29.11 54.61 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -168.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -143.51 -63.34 0.4 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.491 1.517 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.12 145.75 4.74 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.63 71.08 7.49 Favored 'General case' 0 N--CA 1.461 0.115 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -172.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -107.69 19.96 19.46 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.597 0.759 . . . . 0.0 111.9 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -143.63 33.02 1.28 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -168.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.4 m -72.2 75.05 0.97 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 169.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 68.07 -62.22 0.36 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 127.589 2.356 . . . . 0.0 112.765 172.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -30.33 -77.85 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 128.319 2.648 . . . . 0.0 113.104 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 m -55.62 -38.21 69.2 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.791 0.836 . . . . 0.0 111.938 -174.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -66.74 -44.43 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 m -57.59 -43.71 84.86 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.065 -1.022 . . . . 0.0 109.629 172.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -64.57 -33.06 75.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.184 0.993 . . . . 0.0 111.901 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -63.37 -53.66 49.09 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 109.659 172.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -37.23 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.81 -14.92 63.21 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.057 -0.402 . . . . 0.0 111.827 171.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.0 mt 59.59 42.96 16.51 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.611 1.964 . . . . 0.0 111.604 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -78.5 -31.62 47.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.836 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.78 5.12 0.23 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -169.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.6 m 40.4 58.94 2.19 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.073 1.749 . . . . 0.0 114.549 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.2 t80 68.41 -58.08 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.008 2.123 . . . . 0.0 114.529 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -47.14 -51.45 18.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.864 1.266 . . . . 0.0 112.885 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.2 -43.38 42.69 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.8 mtt -46.82 -45.24 19.98 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 124.54 1.136 . . . . 0.0 111.421 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 t -60.83 -29.31 69.41 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -177.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -83.09 -45.98 13.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.993 0.902 . . . . 0.0 109.387 171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -56.04 -44.28 78.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.932 1.693 . . . . 0.0 111.963 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -60.95 -59.92 12.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.516 -0.755 . . . . 0.0 111.785 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -58.6 -41.21 66.54 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.421 1.414 . . . . 0.0 111.217 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -49.99 -54.35 20.61 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 175.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.7 mt -68.93 -35.31 76.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.773 -0.579 . . . . 0.0 111.565 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -56.66 -50.05 73.23 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.409 0.55 . . . . 0.0 109.597 174.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -60.5 -49.04 79.14 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.921 0.489 . . . . 0.0 110.02 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.408 ' CZ2' HG22 ' A' ' 30' ' ' VAL . 67.6 t90 -49.23 -50.01 40.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.033 0.379 . . . . 0.0 111.009 174.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -48.48 75.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -175.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.32 -42.64 74.01 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 123.075 0.55 . . . . 0.0 111.139 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.52 -51.35 57.59 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.423 0.289 . . . . 0.0 111.116 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 123.735 0.814 . . . . 0.0 112.163 -169.759 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 55.5 mp0 -49.54 -40.12 36.97 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.566 1.546 . . . . 0.0 111.594 175.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.97 -49.98 14.24 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.9 mt -59.25 -44.88 92.36 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.885 0.474 . . . . 0.0 111.593 -172.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -64.86 -56.78 11.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.237 0.542 . . . . 0.0 111.0 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -48.46 -54.55 13.76 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.892 1.277 . . . . 0.0 110.293 172.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -51.45 -53.14 40.11 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.62 -52.1 60.96 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.548 0.339 . . . . 0.0 110.654 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -61.5 -28.38 69.26 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.584 -0.697 . . . . 0.0 111.84 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.3 m -69.76 -43.59 71.93 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.017 -1.052 . . . . 0.0 108.968 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.48 -42.04 81.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.553 0.741 . . . . 0.0 109.829 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -55.25 -56.25 22.09 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.027 -0.42 . . . . 0.0 110.113 172.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.71 -45.53 81.79 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.929 -0.482 . . . . 0.0 111.07 -178.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -53.24 -53.75 46.2 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.196 0.598 . . . . 0.0 110.105 174.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.2 mtm105 -53.62 -55.89 21.93 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.445 0.298 . . . . 0.0 110.817 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.1 mm -51.7 -51.68 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.992 0.917 . . . . 0.0 109.111 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.55 -40.5 71.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.392 0.277 . . . . 0.0 111.363 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.6 mt -86.57 -2.32 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.53 25.07 71.33 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 121.092 -1.005 . . . . 0.0 112.6 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -178.33 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -55.5 -45.7 78.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.97 -49.89 28.38 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 123.302 0.477 . . . . 0.0 112.762 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.26 -56.15 23.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.312 0.645 . . . . 0.0 109.925 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.07 -54.58 37.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.945 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 80.1 mmm -54.69 -44.19 73.15 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.714 1.206 . . . . 0.0 110.468 174.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -42.95 -56.09 4.59 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 125.328 1.442 . . . . 0.0 111.566 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.92 -49.85 64.25 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.765 0.283 . . . . 0.0 111.724 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.76 -34.56 64.77 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -134.78 -59.61 0.8 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.472 1.109 . . . . 0.0 110.93 -172.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.47 146.24 4.61 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 -171.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -81.89 69.59 8.61 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 117.646 0.723 . . . . 0.0 111.422 -169.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -106.41 -155.05 0.53 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 165.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 66.43 -82.13 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.975 0.91 . . . . 0.0 110.61 168.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m 45.05 -72.94 0.0 OUTLIER 'General case' 0 C--N 1.339 0.126 0 C-N-CA 130.011 3.324 . . . . 0.0 115.432 172.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -159.14 -50.33 0.06 Allowed 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.9 p -56.37 -72.28 0.08 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.244 1.017 . . . . 0.0 110.735 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.3 m -55.9 -37.55 69.04 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.494 0.718 . . . . 0.0 111.217 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.75 -42.68 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.618 -0.676 . . . . 0.0 111.871 172.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.4 m -65.23 -43.26 92.01 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.487 -0.758 . . . . 0.0 110.517 173.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -54.69 -47.4 73.72 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.609 0.64 . . . . 0.0 110.456 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -55.75 -59.18 5.23 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.898 1.279 . . . . 0.0 110.439 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -55.09 -38.17 67.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.1 0.96 . . . . 0.0 112.508 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.03 -8.95 58.85 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.254 1.022 . . . . 0.0 112.625 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 58.05 47.79 14.16 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.273 1.429 . . . . 0.0 110.784 -175.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.01 -47.91 15.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.052 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.14 96.57 1.09 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.9 p -68.12 81.55 0.22 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.565 0.746 . . . . 0.0 111.039 -174.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 78.4 t80 75.53 -48.56 0.61 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.97 2.108 . . . . 0.0 113.341 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -35.78 -61.52 0.47 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.504 1.922 . . . . 0.0 112.415 -169.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -79.78 -44.77 20.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.779 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.7 mtp -42.7 -45.52 4.75 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 125.028 1.331 . . . . 0.0 112.094 -174.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.1 t -60.64 -34.07 73.73 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -79.03 -44.47 22.15 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.082 0.944 . . . . 0.0 109.36 174.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -35.1 75.32 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.056 1.342 . . . . 0.0 113.406 -170.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -58.69 -61.62 7.33 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-O 117.769 -1.11 . . . . 0.0 112.395 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -58.74 -40.15 75.53 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.676 1.584 . . . . 0.0 110.982 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -51.66 -52.51 47.47 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.099 0.96 . . . . 0.0 111.387 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.1 mt -71.24 -33.89 70.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.558 -0.714 . . . . 0.0 111.525 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -57.68 -47.23 82.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -59.01 -47.83 83.78 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -51.11 -47.82 61.85 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.913 0.324 . . . . 0.0 110.565 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.49 94.68 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -41.08 81.06 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.878 0.471 . . . . 0.0 110.259 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -68.16 -52.66 32.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.919 0.39 . . . . 0.0 110.442 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.2 0 C-N-CA 124.328 1.051 . . . . 0.0 112.23 -171.326 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -52.09 -42.4 63.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.432 0.693 . . . . 0.0 111.197 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -37.92 62.64 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.846 -0.534 . . . . 0.0 109.82 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.494 HD12 ' C ' ' A' ' 9' ' ' LEU . 0.1 OUTLIER -59.55 -46.36 89.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.445 -0.788 . . . . 0.0 111.476 178.126 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -58.77 -58.49 8.36 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.77 1.168 . . . . 0.0 111.175 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -46.22 -54.41 8.83 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.707 0.803 . . . . 0.0 110.189 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.24 -49.96 65.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.461 1.105 . . . . 0.0 111.087 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.23 -53.77 54.35 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.521 0.6 . . . . 0.0 110.496 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -56.91 -43.04 80.98 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.314 0.578 . . . . 0.0 110.751 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.2 m -60.99 -48.01 83.82 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -54.7 -47.29 73.88 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.379 0.672 . . . . 0.0 110.052 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.44 -47.36 82.01 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.204 0.456 . . . . 0.0 111.276 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.81 -44.78 82.32 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.903 -0.498 . . . . 0.0 111.001 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.4 mmt-85 -59.59 -46.15 89.8 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.607 0.639 . . . . 0.0 110.883 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -54.7 -46.99 74.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.34 0.656 . . . . 0.0 110.596 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt -61.26 -50.15 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.348 0.659 . . . . 0.0 109.812 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -47.44 67.36 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.822 0.849 . . . . 0.0 110.329 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -67.42 -12.97 61.55 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.751 0.82 . . . . 0.0 112.353 178.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.33 33.87 86.25 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.999 0.904 . . . . 0.0 108.972 -175.039 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 120.461 0.172 . . . . 0.0 110.603 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -51.44 -46.48 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 172.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -55.47 -45.81 82.79 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 118.109 0.413 . . . . 0.0 112.517 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.99 -51.64 66.07 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 121.643 0.735 . . . . 0.0 110.41 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.1 85.51 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.752 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -42.23 80.3 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 124.097 0.959 . . . . 0.0 109.841 172.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -56.91 5.71 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 125.358 1.456 . . . . 0.0 111.154 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.65 -51.12 70.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.74 0.27 . . . . 0.0 111.615 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 mt -81.59 -25.21 35.93 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 115.135 1.531 . . . . 0.0 115.135 -168.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -143.31 -63.11 0.4 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.772 1.229 . . . . 0.0 111.133 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.27 145.28 5.18 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.79 56.5 3.08 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 117.839 0.82 . . . . 0.0 112.51 -167.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -88.6 -175.74 5.04 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 168.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 68.51 40.41 1.94 Allowed 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.972 -1.08 . . . . 0.0 112.634 169.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.3 p -74.96 52.5 0.55 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.965 1.306 . . . . 0.0 109.906 171.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 64.88 -44.86 0.33 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.541 1.936 . . . . 0.0 113.532 -169.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.1 p -44.12 -68.48 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.529 1.932 . . . . 0.0 111.864 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -35.54 73.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.843 0.857 . . . . 0.0 111.323 -174.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.0 mm -64.41 -46.67 92.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.257 0.623 . . . . 0.0 109.507 174.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.1 m -56.52 -45.6 81.0 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.983 -1.073 . . . . 0.0 110.22 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -57.04 -41.48 78.74 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.064 -0.397 . . . . 0.0 111.572 174.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -58.26 -52.61 64.86 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 122.973 0.509 . . . . 0.0 110.298 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.33 -27.47 69.05 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.8 -8.19 56.85 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.573 0.624 . . . . 0.0 111.87 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.31 42.14 25.38 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.987 1.715 . . . . 0.0 110.352 -171.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -79.77 -38.14 33.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.653 -173.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 mt -80.45 56.12 2.47 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.948 0.899 . . . . 0.0 112.873 -169.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.2 m 21.7 53.57 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 130.861 3.664 . . . . 0.0 116.94 169.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.1 t80 65.25 -57.32 0.3 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.321 2.249 . . . . 0.0 114.016 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -38.95 -53.09 1.77 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.447 1.899 . . . . 0.0 113.235 -175.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -72.7 -58.02 3.67 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.501 0.667 . . . . 0.0 109.217 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.3 mtp -44.1 -44.79 7.78 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.724 2.01 . . . . 0.0 112.256 -173.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.33 -31.62 72.9 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.811 0.845 . . . . 0.0 112.613 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -82.16 -37.83 25.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 171.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.071 0.948 . . . . 0.0 110.983 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -51.25 -68.32 0.4 Allowed Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.645 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.33 -37.63 94.22 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.862 1.708 . . . . 0.0 111.524 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -53.63 -54.06 43.01 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.678 0.672 . . . . 0.0 111.293 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 57.0 mt -67.65 -37.96 83.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 121.851 -0.531 . . . . 0.0 111.241 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -57.09 -49.97 74.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.349 0.522 . . . . 0.0 109.856 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -66.43 -42.61 87.43 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 122.246 -0.284 . . . . 0.0 110.482 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -50.59 -49.45 56.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.965 0.348 . . . . 0.0 110.173 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.24 -50.68 69.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -178.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -39.71 61.89 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.637 0.775 . . . . 0.0 111.15 178.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -71.82 -52.41 17.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 117.859 0.3 . . . . 0.0 110.82 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.151 0.98 . . . . 0.0 112.354 -170.86 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp . . . . . 0 CA--C 1.533 0.29 0 N-CA-C 110.709 -0.108 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -49.87 -44.78 50.04 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.328 1.451 . . . . 0.0 111.776 174.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.01 -51.58 37.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.0 mt -53.4 -48.83 68.32 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.787 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -59.27 -61.65 2.47 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.066 0.848 . . . . 0.0 111.247 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -50.62 -52.69 37.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.725 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.52 -50.45 65.42 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.131 0.572 . . . . 0.0 111.1 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -53.1 61.77 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.393 0.677 . . . . 0.0 110.899 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -55.11 -47.02 75.58 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.319 0.58 . . . . 0.0 109.804 177.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.8 m -62.72 -39.09 92.96 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 123.238 0.615 . . . . 0.0 110.579 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -60.02 -51.39 69.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.208 1.003 . . . . 0.0 108.885 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -56.7 -53.69 54.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.398 0.279 . . . . 0.0 110.814 175.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.45 -52.64 53.06 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.662 -0.649 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -62.55 -48.06 81.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.371 0.668 . . . . 0.0 110.761 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 -57.64 -44.15 85.4 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.67 0.668 . . . . 0.0 109.451 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 84.9 mt -59.19 -47.76 89.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 O-C-N 122.081 -0.387 . . . . 0.0 110.003 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -56.36 -40.24 74.19 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.65 0.659 . . . . 0.0 111.503 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.2 mt -72.68 -1.39 16.12 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.48 25.49 74.11 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 121.236 -0.915 . . . . 0.0 111.664 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 . . . . . 0 N--CA 1.452 -0.335 0 C-N-CA 123.871 0.868 . . . . 0.0 108.879 -178.701 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 t70 . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.7 t -58.09 -56.05 18.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.68 -49.05 12.53 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-N 118.095 0.407 . . . . 0.0 112.25 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.88 -52.56 65.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.709 1.204 . . . . 0.0 110.049 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.59 -47.72 78.94 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.844 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 48.3 mmm -56.15 -46.31 79.31 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 121.695 -0.628 . . . . 0.0 109.637 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -41.49 -56.65 3.45 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 125.546 1.545 . . . . 0.0 111.662 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -65.36 -50.41 65.65 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.361 0.665 . . . . 0.0 111.801 -178.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.89 -48.18 66.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.163 0.438 . . . . 0.0 111.959 -174.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 4.3 m-85 -126.41 -56.09 1.42 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.246 1.019 . . . . 0.0 111.154 -169.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.28 152.53 6.29 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 107.934 -2.066 . . . . 0.0 107.934 -169.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -81.02 54.35 2.19 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.887 -0.773 . . . . 0.0 111.076 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.69 -15.1 61.24 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.885 -0.51 . . . . 0.0 111.501 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.78 43.8 1.74 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.104 1.762 . . . . 0.0 107.725 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.6 p -61.65 -62.8 1.55 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.838 0.855 . . . . 0.0 110.349 -169.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.475 ' NE2' ' H ' ' A' ' 45' ' ' THR . 0.2 OUTLIER -161.48 -55.31 0.05 OUTLIER 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.199 0.599 . . . . 0.0 112.226 178.688 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.475 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -57.96 -52.93 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.407 1.083 . . . . 0.0 109.423 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 p -55.03 -51.53 66.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.184 0.994 . . . . 0.0 111.67 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -59.39 -46.98 92.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 O-C-N 122.02 -0.425 . . . . 0.0 110.71 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.0 m -56.43 -50.5 71.47 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.938 0.875 . . . . 0.0 110.77 175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -62.03 -30.1 70.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.765 1.226 . . . . 0.0 111.454 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -61.23 -57.4 12.56 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.176 0.591 . . . . 0.0 109.796 173.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.07 -30.52 68.13 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.61 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.34 -7.45 59.07 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.05 36.95 13.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.14 1.776 . . . . 0.0 112.106 -171.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -80.19 -31.57 38.74 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.844 -0.535 . . . . 0.0 111.861 -175.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -79.11 53.53 1.46 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.718 0.807 . . . . 0.0 111.554 -175.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.7 m -5.23 71.57 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 130.407 3.483 . . . . 0.0 116.49 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.7 t80 66.64 -57.81 0.39 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.938 2.095 . . . . 0.0 114.262 174.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.8 -55.56 3.6 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.517 1.527 . . . . 0.0 113.734 -169.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.18 -46.92 39.05 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 57.4 mtp -50.82 -42.11 58.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.342 1.457 . . . . 0.0 111.273 -173.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.4 t -64.36 -28.42 69.69 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.782 0.833 . . . . 0.0 112.663 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -82.7 -45.06 14.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.863 0.839 . . . . 0.0 109.425 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.267 0.1 OUTLIER -59.84 -46.92 87.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.819 1.247 . . . . 0.0 112.609 -178.249 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -55.12 -58.3 15.55 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -59.73 -34.81 95.96 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.848 1.698 . . . . 0.0 111.488 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.9 mp -63.69 -45.35 90.45 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 19.1 mt -62.9 -39.63 95.11 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 173.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.64 -50.37 74.1 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.899 0.772 . . . . 0.0 109.361 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.65 -47.8 81.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.358 0.663 . . . . 0.0 110.27 175.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -53.02 -43.45 66.56 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 122.228 -0.295 . . . . 0.0 110.487 174.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.88 -46.78 80.32 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -39.64 73.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.028 0.531 . . . . 0.0 110.611 176.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.52 -58.1 4.06 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.94 0.496 . . . . 0.0 111.537 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.151 0 C-N-CA 124.601 1.16 . . . . 0.0 112.158 -169.896 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 C--O 1.226 -0.155 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.4 mp0 -49.84 -45.43 50.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.198 1.399 . . . . 0.0 111.05 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.21 -48.36 57.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -55.79 -54.04 49.26 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.414 0.686 . . . . 0.0 111.444 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.04 -56.59 20.24 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-N 119.027 0.831 . . . . 0.0 111.137 -177.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.38 -54.88 18.5 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -54.21 -48.96 70.45 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.904 0.482 . . . . 0.0 110.744 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -52.37 65.81 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.142 0.977 . . . . 0.0 111.066 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -59.42 -46.97 87.21 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.627 -0.67 . . . . 0.0 110.122 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.8 m -60.71 -38.42 84.99 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 122.022 -0.423 . . . . 0.0 110.129 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.39 -46.28 90.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.847 0.859 . . . . 0.0 109.171 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -56.21 -50.67 70.6 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.266 0.484 . . . . 0.0 110.444 174.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -56.86 -48.5 77.97 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.162 -0.961 . . . . 0.0 110.885 178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -57.55 -42.37 82.84 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.934 -0.479 . . . . 0.0 111.061 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -54.64 -49.08 71.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.489 1.115 . . . . 0.0 110.349 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.2 mm -61.71 -48.82 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.233 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.95 -44.43 87.0 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.259 0.481 . . . . 0.0 111.389 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.2 mt -64.43 -37.98 89.44 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.255 0.622 . . . . 0.0 110.35 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.55 34.36 6.08 Favored Glycine 0 CA--C 1.525 0.719 0 C-N-CA 124.369 0.985 . . . . 0.0 111.348 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 122.938 1.351 . . . . 0.0 108.258 173.043 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.1 t70 . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.0 t -42.42 -43.46 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 124.28 1.032 . . . . 0.0 109.259 167.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.42 -45.63 16.68 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.125 0.869 . . . . 0.0 113.566 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.6 tp -70.07 -52.79 21.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.725 0.774 . . . . 0.0 109.87 -176.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.97 80.99 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.386 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.7 mmm -53.92 -47.3 71.33 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 110.318 170.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.48 -54.2 3.38 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 125.308 1.432 . . . . 0.0 111.461 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.62 -53.14 37.41 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 mt -76.15 -31.94 58.83 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -168.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -135.63 -56.69 0.79 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.461 1.105 . . . . 0.0 110.52 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.83 156.17 8.63 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -170.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.66 74.12 5.2 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.839 0.82 . . . . 0.0 110.489 -169.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -109.38 159.91 16.61 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 73.74 33.88 0.98 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.509 1.123 . . . . 0.0 113.771 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.4 m -75.05 65.29 1.45 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 64.05 -59.15 0.2 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.163 2.185 . . . . 0.0 112.5 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.1 p -32.19 -66.28 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.002 1.721 . . . . 0.0 113.081 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.17 -30.93 71.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.922 0.889 . . . . 0.0 112.383 -177.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 26.0 mm -67.15 -49.06 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.2 m -52.45 -53.61 43.18 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.579 -0.701 . . . . 0.0 110.373 173.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -59.36 -37.81 78.82 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.616 0.766 . . . . 0.0 111.364 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 63' ' ' LEU . 7.8 t80 -61.37 -60.3 3.93 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.268 0.627 . . . . 0.0 110.039 177.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.26 -41.59 76.05 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.12 -11.98 58.7 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 55.39 46.59 23.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.303 1.441 . . . . 0.0 110.911 -173.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -79.92 -41.12 26.73 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.439 1.095 . . . . 0.0 110.929 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.3 mt -77.91 -162.23 0.31 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.3 m -154.73 173.29 16.62 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 120.772 -1.205 . . . . 0.0 109.104 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -41.53 0.86 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.07 2.548 . . . . 0.0 112.07 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -39.61 -39.48 0.75 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.131 1.372 . . . . 0.0 112.023 176.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -104.75 -56.02 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.685 1.594 . . . . 0.0 109.743 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.0 mtt -47.15 -39.52 13.8 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.128 1.771 . . . . 0.0 113.945 -170.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.0 t -66.42 -25.31 66.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -90.03 -40.28 12.41 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.0 OUTLIER -55.93 -43.23 77.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.332 0.653 . . . . 0.0 111.814 -178.438 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -54.02 -65.77 1.12 Allowed Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 118.978 -0.534 . . . . 0.0 112.216 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -58.78 -40.75 69.69 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.891 1.728 . . . . 0.0 111.655 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 tt -49.19 -51.99 29.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 111.172 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.55 -40.21 80.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 121.775 -0.578 . . . . 0.0 111.275 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -61.68 -44.7 96.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.453 1.024 . . . . 0.0 110.259 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -61.65 -46.67 88.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.716 -0.615 . . . . 0.0 109.812 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -50.79 -46.58 59.7 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.791 0.269 . . . . 0.0 110.32 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.75 -48.85 79.93 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.761 0.824 . . . . 0.0 109.239 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.25 -48.82 77.88 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -57.6 -48.57 79.03 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.15 0.58 . . . . 0.0 109.64 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 C-N-CA 124.61 1.164 . . . . 0.0 110.993 176.59 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.484 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -45.67 -47.53 15.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.241 1.416 . . . . 0.0 112.003 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -74.32 -49.66 21.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.73 -48.99 71.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.366 0.667 . . . . 0.0 111.496 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -61.19 -61.13 2.78 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.615 0.643 . . . . 0.0 110.843 -178.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -51.38 -48.28 62.61 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.413 0.685 . . . . 0.0 110.509 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -54.72 -51.83 64.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.763 0.425 . . . . 0.0 110.48 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.38 -52.83 58.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.35 0.523 . . . . 0.0 111.274 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -54.5 -46.45 73.47 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.896 0.379 . . . . 0.0 110.017 177.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.0 m -59.75 -42.54 93.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.821 0.449 . . . . 0.0 110.383 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -60.64 -44.87 95.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.844 0.458 . . . . 0.0 109.917 177.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -59.3 -48.92 79.81 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.724 -0.61 . . . . 0.0 111.079 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -55.45 -50.26 70.31 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.249 0.62 . . . . 0.0 110.141 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -52.01 -55.63 19.31 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.373 173.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -53.19 -49.27 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 110.439 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.1 mt -60.39 -44.94 97.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.539 0.736 . . . . 0.0 110.128 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -57.92 -41.37 82.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.749 0.704 . . . . 0.0 111.075 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.09 -10.81 59.95 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 173.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.15 73.88 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 123.623 0.769 . . . . 0.0 109.901 -176.692 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 CA--C 1.531 0.227 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.2 t -55.66 -41.02 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.9 -52.77 24.81 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.097 0.856 . . . . 0.0 112.993 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 tp -72.32 -47.52 49.1 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 117.997 0.898 . . . . 0.0 110.639 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.63 -51.71 64.55 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.288 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 62.4 mtp -64.56 -37.6 88.11 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 121.895 -0.503 . . . . 0.0 110.699 170.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -37.83 -56.75 1.68 Allowed Glycine 0 C--O 1.229 -0.206 0 C-N-CA 126.083 1.801 . . . . 0.0 111.262 172.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -76.1 -45.94 31.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.6 tp -72.02 -16.49 62.06 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -170.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -153.81 -64.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.856 1.662 . . . . 0.0 111.097 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.94 149.08 6.03 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 -169.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.93 67.77 8.05 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 117.746 0.773 . . . . 0.0 111.137 -168.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -121.76 170.73 9.46 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.501 1.52 . . . . 0.0 107.53 171.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.428 ' HB3' HG12 ' A' ' 47' ' ' ILE . 79.3 m-85 62.26 45.06 7.07 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.305 1.042 . . . . 0.0 111.44 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -62.53 -59.09 5.44 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.2 1.0 . . . . 0.0 109.072 169.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.59 -51.38 0.06 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.64 1.576 . . . . 0.0 108.849 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.9 p -50.63 -58.67 5.3 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.353 1.061 . . . . 0.0 111.742 -175.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.38 78.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.7 1.2 . . . . 0.0 111.1 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.428 HG12 ' HB3' ' A' ' 42' ' ' PHE . 7.8 mm -63.82 -56.54 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.799 0.84 . . . . 0.0 109.239 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.9 m -50.33 -45.38 54.82 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.215 -0.928 . . . . 0.0 111.275 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -60.8 -37.48 82.09 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.416 ' CD2' HD11 ' A' ' 63' ' ' LEU . 6.2 t80 -59.0 -55.49 34.46 Favored 'General case' 0 CA--C 1.522 -0.114 0 CA-C-N 118.71 0.687 . . . . 0.0 109.699 172.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.04 -31.46 70.0 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.8 -2.57 40.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.177 0.591 . . . . 0.0 112.421 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mp 53.52 35.75 21.59 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.88 1.672 . . . . 0.0 112.252 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -31.53 50.83 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.99 39.68 0.51 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.961 0.904 . . . . 0.0 109.937 176.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.8 m -37.83 94.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 128.864 2.866 . . . . 0.0 115.567 -167.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.9 t80 69.2 -56.89 0.54 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 128.197 2.599 . . . . 0.0 113.63 173.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -39.72 -51.6 2.33 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.535 1.934 . . . . 0.0 112.83 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -47.53 14.98 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.7 mtt -44.24 -40.09 4.91 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.458 1.903 . . . . 0.0 112.847 -169.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 24.2 t -65.07 -25.97 68.04 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 118.473 -1.291 . . . . 0.0 112.912 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -90.17 -45.16 9.28 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 169.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -56.95 -42.28 79.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 125.143 1.377 . . . . 0.0 112.476 -174.256 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.6 -62.0 6.83 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.362 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.96 -38.35 92.5 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.342 1.361 . . . . 0.0 111.735 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.31 -55.49 27.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.642 0.777 . . . . 0.0 111.449 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.38 -37.45 83.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 121.074 -1.016 . . . . 0.0 111.254 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -58.5 -47.85 82.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.594 -0.691 . . . . 0.0 109.276 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -61.55 -44.05 97.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.359 0.663 . . . . 0.0 110.085 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.7 t90 -52.49 -49.29 65.02 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.769 0.713 . . . . 0.0 110.563 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.25 -48.55 77.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.549 0.74 . . . . 0.0 109.427 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -56.55 -45.13 81.4 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 122.687 0.395 . . . . 0.0 110.654 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.67 -47.55 85.74 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.978 0.511 . . . . 0.0 110.86 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.264 0 C-N-CA 123.466 0.706 . . . . 0.0 110.998 -179.743 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt . . . . . 0 CA--C 1.53 0.206 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -50.3 -37.17 35.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.572 1.149 . . . . 0.0 111.875 173.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -83.86 -45.01 13.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.986 0.514 . . . . 0.0 110.381 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.15 -46.87 62.16 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.657 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -57.76 -63.53 1.21 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.133 0.879 . . . . 0.0 111.511 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -55.7 -46.01 77.76 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.551 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.06 -52.41 64.37 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.98 0.512 . . . . 0.0 110.093 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.27 74.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.886 -0.509 . . . . 0.0 109.946 -177.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -56.19 -33.98 65.8 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.969 -0.457 . . . . 0.0 111.569 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.3 m -69.52 -40.43 76.93 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 121.469 -0.769 . . . . 0.0 109.449 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.27 -41.57 84.58 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -57.81 -51.6 68.93 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.97 -0.456 . . . . 0.0 110.814 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -55.57 -48.16 75.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.102 0.561 . . . . 0.0 110.417 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.67 -46.77 86.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.335 0.654 . . . . 0.0 110.771 176.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 mtm105 -55.15 -50.22 69.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.813 -0.554 . . . . 0.0 110.99 174.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.9 mt -54.71 -51.25 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -54.51 -45.36 73.28 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 122.678 0.391 . . . . 0.0 111.358 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 mt -74.16 -17.74 60.87 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.658 0.783 . . . . 0.0 112.368 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.02 32.19 72.99 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.051 0.834 . . . . 0.0 111.07 -170.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 . . . . . 0 N--CA 1.457 -0.117 0 C-N-CA 123.811 0.844 . . . . 0.0 111.088 -173.686 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.3 -48.46 32.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.939 170.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -49.99 17.63 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.275 0.94 . . . . 0.0 112.095 176.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 tp -62.39 -53.35 56.27 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.802 0.841 . . . . 0.0 110.702 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.94 78.12 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.366 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtp -55.39 -43.01 74.8 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 123.768 0.827 . . . . 0.0 110.233 169.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.24 -53.76 6.57 Favored Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.456 1.503 . . . . 0.0 111.73 168.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -62.65 -48.8 77.74 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.409 0.283 . . . . 0.0 111.373 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.65 -48.36 22.44 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 3.8 m-85 -125.12 -62.47 1.22 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.358 1.863 . . . . 0.0 112.952 -168.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.52 138.49 2.73 Favored Glycine 0 CA--C 1.531 1.089 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.52 59.15 4.5 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.506 0.722 . . . . 0.0 111.593 -167.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.57 -20.0 19.34 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -172.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -101.78 78.6 1.83 Allowed 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -166.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.5 t -73.47 171.14 13.7 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 165.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.28 -38.61 42.0 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -54.17 -57.76 9.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.569 1.147 . . . . 0.0 111.854 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -41.49 92.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.62 0.768 . . . . 0.0 110.109 -176.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -59.27 -43.2 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 122.015 -0.428 . . . . 0.0 110.966 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.2 m -59.12 -43.24 91.93 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 118.692 0.678 . . . . 0.0 110.093 174.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -47.87 61.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.611 0.364 . . . . 0.0 110.815 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.564 ' CD1' HD13 ' A' ' 63' ' ' LEU . 27.5 t80 -62.93 -54.93 30.89 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 122.37 0.268 . . . . 0.0 111.624 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.51 -23.24 66.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.096 0.958 . . . . 0.0 113.11 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.26 -7.62 59.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.844 0.858 . . . . 0.0 111.186 169.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp 52.24 44.34 29.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 126.387 1.875 . . . . 0.0 110.019 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -79.52 -33.58 41.9 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.024 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.5 mt -78.35 46.09 0.6 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.878 0.871 . . . . 0.0 112.621 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.3 t 60.77 -76.59 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.067 2.147 . . . . 0.0 113.179 174.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.1 t80 176.28 -47.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 126.554 1.942 . . . . 0.0 107.795 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -54.03 2.73 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.562 1.545 . . . . 0.0 112.995 -176.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -76.24 -56.45 4.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 37.9 mtp -38.33 -49.04 1.39 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.438 2.295 . . . . 0.0 112.178 -178.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.13 -41.7 84.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.0 0.92 . . . . 0.0 112.589 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -77.68 -34.72 52.81 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.3 0.64 . . . . 0.0 109.902 175.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.564 HD13 ' CD1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -53.77 -50.89 65.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.084 1.353 . . . . 0.0 110.511 177.611 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -46.2 -64.14 1.06 Allowed Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.26 -34.82 98.12 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 121.973 1.782 . . . . 0.0 111.837 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.5 mp -61.61 -51.99 66.24 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.57 -39.24 90.46 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.652 0.381 . . . . 0.0 111.283 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.15 -51.86 67.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.941 -0.474 . . . . 0.0 110.182 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.14 -43.5 98.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.7 0.4 . . . . 0.0 110.157 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -52.59 -45.29 66.44 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 172.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.11 -46.56 80.53 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.66 -40.92 66.31 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.985 0.514 . . . . 0.0 110.59 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -70.03 -55.3 9.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.769 0.428 . . . . 0.0 111.543 177.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.192 0 C-N-CA 124.17 0.988 . . . . 0.0 112.766 -169.115 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 CA--C 1.527 0.084 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -37.24 -51.75 1.04 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.116 1.366 . . . . 0.0 111.455 174.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.22 -48.73 78.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.795 0.838 . . . . 0.0 110.05 -178.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.42 -48.32 82.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.431 1.092 . . . . 0.0 110.155 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.09 -58.16 9.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.716 0.769 . . . . 0.0 109.896 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -56.32 -51.51 67.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.511 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -51.53 -52.86 43.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 110.822 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -53.48 44.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.032 0.833 . . . . 0.0 110.708 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -67.25 -12.54 60.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.2 m -90.29 -38.19 13.56 Favored 'General case' 0 C--O 1.228 -0.076 0 C-N-CA 124.129 0.972 . . . . 0.0 109.537 175.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -53.05 -44.83 67.72 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.848 0.859 . . . . 0.0 108.885 173.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -48.58 -56.86 7.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.245 0.618 . . . . 0.0 111.602 169.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -60.4 -49.38 77.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 O-C-N 121.991 -0.443 . . . . 0.0 110.483 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -55.95 -52.09 65.39 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.895 0.316 . . . . 0.0 110.188 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -50.99 -50.56 58.19 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.252 1.021 . . . . 0.0 110.786 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -59.98 -51.43 72.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.085 0.554 . . . . 0.0 110.253 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.23 -40.71 82.44 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.591 0.632 . . . . 0.0 111.532 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.5 mt -67.8 -16.3 64.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.696 0.799 . . . . 0.0 111.449 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.57 29.77 74.3 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -173.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-O 121.932 0.872 . . . . 0.0 109.147 -174.395 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.6 t -59.17 -46.55 92.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.64 -52.6 24.23 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.9 tp -60.08 -54.47 45.6 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 123.518 0.727 . . . . 0.0 110.808 -178.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.85 91.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.127 -176.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.416 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 73.9 mmm -56.83 -45.15 82.51 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.803 -0.561 . . . . 0.0 110.084 171.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.54 -55.72 5.17 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 124.916 1.246 . . . . 0.0 111.224 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 tptp -52.93 -48.85 67.01 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.652 0.781 . . . . 0.0 112.293 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.6 mt -90.01 -35.91 15.24 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -169.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -132.57 -59.26 0.91 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.259 1.423 . . . . 0.0 110.889 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.98 142.69 3.46 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 107.85 -2.1 . . . . 0.0 107.85 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -79.41 38.36 0.36 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.309 1.054 . . . . 0.0 113.314 -168.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.56 39.11 0.59 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.463 -0.773 . . . . 0.0 111.134 -174.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -144.19 31.14 1.25 Allowed 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 125.51 1.524 . . . . 0.0 108.996 -169.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.7 m -76.66 67.25 2.74 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.488 1.115 . . . . 0.0 108.163 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 75.15 -48.0 0.62 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.524 1.929 . . . . 0.0 113.124 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.5 p -49.23 -79.41 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.075 1.35 . . . . 0.0 112.266 -172.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.2 p -54.31 -44.97 72.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.404 1.082 . . . . 0.0 110.525 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.34 -53.62 37.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.716 0.806 . . . . 0.0 111.202 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.8 p -60.35 -48.88 79.85 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.775 -0.578 . . . . 0.0 110.15 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -58.27 -34.95 71.06 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.423 . . . . 0.0 111.984 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -69.43 -53.05 21.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 123.629 0.772 . . . . 0.0 110.307 178.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -55.6 -40.25 71.82 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.832 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.88 -10.79 59.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.359 1.064 . . . . 0.0 112.838 173.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.4 mt 58.74 45.66 15.36 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 127.121 2.168 . . . . 0.0 112.767 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.32 -30.45 30.45 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.844 1.258 . . . . 0.0 111.119 176.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -80.26 47.92 0.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.981 0.912 . . . . 0.0 113.094 -168.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 m -16.99 84.31 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 129.545 3.138 . . . . 0.0 116.82 -171.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.2 t80 66.05 -58.08 0.34 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.714 2.406 . . . . 0.0 114.725 172.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -44.25 -50.54 8.84 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.612 1.565 . . . . 0.0 112.379 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -47.07 21.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.0 mtt -45.6 -46.15 14.17 Favored 'General case' 0 C--O 1.225 -0.237 0 C-N-CA 125.22 1.408 . . . . 0.0 111.636 -174.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.9 t -64.82 -22.78 67.06 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -174.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -90.04 -46.87 8.21 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.369 1.08 . . . . 0.0 108.696 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.23 -38.74 77.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.971 1.708 . . . . 0.0 111.734 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -61.39 -63.04 4.77 Favored Pre-proline 0 N--CA 1.452 -0.327 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.16 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -58.1 -39.94 81.27 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 CA-C-N 120.869 1.346 . . . . 0.0 111.181 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.62 -57.23 11.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.18 0.592 . . . . 0.0 111.433 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.2 mt -69.43 -34.11 73.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -58.38 -49.53 76.91 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.018 0.827 . . . . 0.0 109.08 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -62.29 -43.75 98.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.416 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 67.0 t90 -53.16 -49.53 66.42 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 117.906 0.321 . . . . 0.0 110.978 172.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -50.62 72.5 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -174.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -54.31 -53.01 59.62 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.37 0.668 . . . . 0.0 110.84 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -56.42 -51.87 66.76 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.378 0.671 . . . . 0.0 110.969 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.167 0 C-N-CA 123.312 0.645 . . . . 0.0 110.207 178.823 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -40.15 -42.37 1.45 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.991 1.716 . . . . 0.0 112.467 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -74.59 -48.93 23.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.588 0.755 . . . . 0.0 110.244 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.11 -45.67 90.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.747 0.819 . . . . 0.0 111.088 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -57.43 -60.33 3.81 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.381 0.992 . . . . 0.0 111.04 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -56.91 -46.42 81.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.224 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -54.44 -48.6 71.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.329 0.513 . . . . 0.0 111.042 176.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.8 -51.41 67.19 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.614 1.166 . . . . 0.0 110.465 -176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -57.15 -45.28 83.73 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.502 0.668 . . . . 0.0 109.563 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.1 m -64.26 -32.18 73.67 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.909 -0.494 . . . . 0.0 110.494 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -63.28 -48.07 79.67 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.764 1.166 . . . . 0.0 109.345 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -52.3 -53.01 49.69 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 171.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -59.37 -44.35 92.73 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.649 -0.657 . . . . 0.0 111.81 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -59.12 -48.46 81.52 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.498 0.719 . . . . 0.0 110.312 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 64.9 ttp85 -52.04 -49.38 63.56 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.654 0.782 . . . . 0.0 110.252 175.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.03 -47.4 91.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 122.702 0.401 . . . . 0.0 110.143 178.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -59.26 -41.14 88.09 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.835 0.743 . . . . 0.0 111.604 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.53 -17.66 64.11 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.027 -0.42 . . . . 0.0 111.695 172.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.43 28.46 71.18 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -173.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 N--CA 1.454 -0.274 0 CA-C-N 117.47 0.635 . . . . 0.0 109.793 -176.745 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t0 . . . . . 0 C--O 1.226 -0.151 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.4 t -52.93 -52.84 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.07 175.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.37 -49.38 45.15 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.266 0.46 . . . . 0.0 112.262 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.4 tp -62.4 -53.64 51.92 Favored 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 121.701 0.762 . . . . 0.0 110.872 -177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.97 92.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.745 0.818 . . . . 0.0 110.387 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -44.99 79.52 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.012 0.525 . . . . 0.0 109.747 171.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.08 -58.03 3.93 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.62 1.581 . . . . 0.0 111.352 169.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.8 -52.75 62.92 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.8 mt -75.34 -34.48 61.2 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -134.96 -59.5 0.79 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.087 0.955 . . . . 0.0 111.067 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 170.63 154.72 9.76 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 -171.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.12 68.24 4.11 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 123.604 0.761 . . . . 0.0 110.57 -169.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -112.29 172.69 6.76 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.59 1.956 . . . . 0.0 107.416 173.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 70.73 19.58 5.92 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -72.92 79.51 1.17 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 169.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 64.46 -67.16 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.412 2.285 . . . . 0.0 112.408 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 p -29.09 -75.45 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 127.829 2.452 . . . . 0.0 113.043 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -46.35 74.45 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.769 1.227 . . . . 0.0 111.251 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.6 mm -58.81 -49.92 81.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.484 1.114 . . . . 0.0 109.584 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.9 m -56.35 -54.1 49.47 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.83 -0.544 . . . . 0.0 110.226 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -71.05 -22.0 62.18 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -176.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 63' ' ' LEU . 12.5 t80 -64.86 -56.26 14.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 169.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.07 -38.32 65.16 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 119.336 -0.364 . . . . 0.0 111.608 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.2 3.22 24.5 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mp 48.13 53.63 11.41 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.769 2.027 . . . . 0.0 114.779 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.55 -55.23 5.0 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.781 0.8 . . . . 0.0 111.326 170.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.98 -27.31 61.33 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -167.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m 67.94 164.88 0.23 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.597 1.159 . . . . 0.0 113.354 175.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -44.51 -45.48 9.29 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.178 1.391 . . . . 0.0 112.367 -169.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -36.05 -48.89 0.62 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 126.487 1.915 . . . . 0.0 113.14 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.58 -47.84 6.35 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 44.8 mtt -50.31 -41.43 51.07 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.922 -171.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.59 -21.33 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -176.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -89.22 -45.13 9.78 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.448 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -61.62 -39.74 92.36 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.36 0.664 . . . . 0.0 112.464 -174.012 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -57.89 -61.68 6.92 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.964 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.35 -39.86 73.2 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.455 1.437 . . . . 0.0 111.341 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 tt -51.5 -52.48 46.42 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.438 0.563 . . . . 0.0 111.155 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.3 -38.74 88.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.67 -0.644 . . . . 0.0 111.398 177.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.1 -48.09 79.46 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.299 0.499 . . . . 0.0 109.703 178.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -69.95 -36.25 75.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.217 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -52.82 -49.12 66.32 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 119.033 0.833 . . . . 0.0 109.644 169.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -52.42 65.73 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.14 -46.61 62.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.641 0.776 . . . . 0.0 110.733 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -64.57 -54.27 34.77 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.007 0.523 . . . . 0.0 110.466 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 C-N-CA 123.659 0.783 . . . . 0.0 110.488 -179.883 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp . . . . . 0 CA--C 1.53 0.182 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -51.39 -46.47 62.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.047 0.939 . . . . 0.0 111.405 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.8 -53.66 25.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.0 mt -54.59 -49.67 69.84 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.948 0.899 . . . . 0.0 111.876 -172.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.61 -60.95 2.98 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.07 0.85 . . . . 0.0 110.837 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.44 -55.87 11.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.659 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -49.42 -51.86 32.52 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.133 0.573 . . . . 0.0 110.748 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.26 -50.1 73.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.737 -0.602 . . . . 0.0 111.425 -174.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -60.2 -29.62 68.83 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.682 -0.636 . . . . 0.0 110.625 175.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.6 m -73.45 -42.57 61.78 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.476 -0.765 . . . . 0.0 109.44 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -52.26 -52.18 54.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -53.29 -54.93 29.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -55.72 -55.22 34.88 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.865 -0.522 . . . . 0.0 111.178 -178.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -60.49 -46.33 90.51 Favored 'General case' 0 C--O 1.224 -0.244 0 O-C-N 121.988 -0.445 . . . . 0.0 110.99 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -47.99 -51.93 21.86 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.675 1.19 . . . . 0.0 110.858 174.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.8 mt -60.36 -51.6 71.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 122.832 0.453 . . . . 0.0 109.876 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -56.34 -40.43 74.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.792 0.724 . . . . 0.0 112.105 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.47 -15.13 62.78 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.149 0.98 . . . . 0.0 111.565 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.78 19.83 79.74 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 123.754 0.692 . . . . 0.0 111.871 -177.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -52.7 -55.15 12.61 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 171.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.41 -49.63 14.95 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.654 0.661 . . . . 0.0 112.04 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.16 -54.37 46.65 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.118 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.24 82.69 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.705 0.802 . . . . 0.0 111.454 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.2 mmm -51.21 -46.13 62.12 Favored 'General case' 0 C--N 1.333 -0.112 0 C-N-CA 125.241 1.416 . . . . 0.0 109.54 169.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -58.1 5.12 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 125.317 1.436 . . . . 0.0 111.882 168.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.45 -50.03 75.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.526 0.33 . . . . 0.0 111.307 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -65.54 -49.41 69.01 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.273 0.488 . . . . 0.0 111.75 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -132.43 -55.42 0.96 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.193 0.997 . . . . 0.0 111.318 -169.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.98 142.26 3.37 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 108.531 -1.827 . . . . 0.0 108.531 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -81.14 74.8 8.13 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.142 0.971 . . . . 0.0 109.397 -174.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -98.02 26.09 5.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.148 167.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -141.99 42.71 1.69 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.27 -0.893 . . . . 0.0 110.073 -168.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.5 m -79.33 173.58 12.44 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -46.88 -44.45 19.63 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.646 0.778 . . . . 0.0 111.834 -171.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 p -48.84 -66.58 0.38 Allowed 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.206 1.402 . . . . 0.0 112.015 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -69.24 -40.7 77.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.714 0.806 . . . . 0.0 111.513 -173.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -61.39 -44.33 98.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.755 -0.591 . . . . 0.0 110.238 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 56.4 m -58.67 -45.06 90.23 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.014 -0.428 . . . . 0.0 110.621 170.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -40.24 66.67 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.541 0.736 . . . . 0.0 111.316 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 67' ' ' LEU . 47.7 t80 -66.41 -60.36 2.83 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.311 1.045 . . . . 0.0 110.911 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -62.29 -26.37 68.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.02 8.13 34.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.858 0.863 . . . . 0.0 111.807 172.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp 43.64 36.38 1.23 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 126.752 2.021 . . . . 0.0 113.089 -178.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 -32.59 59.37 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.8 mt -57.76 -14.66 6.16 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.527 0.731 . . . . 0.0 112.183 168.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.2 m 72.58 -65.97 0.33 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.893 1.677 . . . . 0.0 113.728 168.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -169.26 -52.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.465 0.706 . . . . 0.0 110.443 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -37.62 -57.21 0.98 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.256 1.823 . . . . 0.0 113.295 -173.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -81.97 -43.64 17.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.676 0.751 . . . . 0.0 110.159 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 58.7 mtp -43.53 -42.51 5.01 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 125.023 1.329 . . . . 0.0 112.388 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.1 t -63.06 -21.55 66.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -90.7 -47.2 7.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.098 0.959 . . . . 0.0 109.487 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.64 -52.47 6.36 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.202 1.801 . . . . 0.0 110.371 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -61.47 -57.95 21.83 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 117.493 -1.241 . . . . 0.0 112.096 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -44.27 -49.27 8.96 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.43 2.087 . . . . 0.0 112.295 170.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 mp -60.53 -50.44 73.53 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 -172.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.413 HD12 ' CE2' ' A' ' 50' ' ' PHE . 7.4 mt -64.64 -35.62 81.61 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.07 0.548 . . . . 0.0 111.985 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -62.26 -48.65 78.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -58.25 -46.89 85.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.405 173.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -52.07 -50.21 61.99 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.432 0.56 . . . . 0.0 111.047 175.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -42.26 89.8 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.844 0.458 . . . . 0.0 109.825 -173.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -53.46 -58.98 5.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.125 0.488 . . . . 0.0 109.879 170.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -58.91 -47.5 84.77 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.264 0.626 . . . . 0.0 110.404 -171.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.338 0 C-N-CA 124.794 1.238 . . . . 0.0 111.543 177.432 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -51.08 -46.99 61.95 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.597 1.159 . . . . 0.0 111.169 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.2 mp0 -69.33 -43.98 72.6 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.32 -51.47 45.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.79 1.636 . . . . 0.0 112.098 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -56.49 21.35 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.978 0.894 . . . . 0.0 109.637 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -52.31 -53.96 37.64 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.396 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -51.15 -53.11 37.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.65 1.18 . . . . 0.0 111.003 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.4 -48.09 81.79 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.908 0.483 . . . . 0.0 110.463 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.34 -37.29 86.69 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.145 0.498 . . . . 0.0 111.521 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.4 m -65.71 -36.68 84.32 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 121.81 -0.557 . . . . 0.0 109.884 176.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -56.73 -45.1 82.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.393 0.542 . . . . 0.0 111.142 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -59.47 -49.14 78.94 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.036 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -59.28 -46.94 87.18 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.881 -0.512 . . . . 0.0 110.519 -177.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -63.41 -45.01 92.97 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.492 0.717 . . . . 0.0 110.319 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -54.24 -48.24 71.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.506 0.722 . . . . 0.0 110.246 174.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.3 mt -61.9 -40.69 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.051 0.54 . . . . 0.0 109.82 177.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -61.04 -43.17 99.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.446 0.567 . . . . 0.0 111.26 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.27 -37.89 84.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.456 0.571 . . . . 0.0 110.244 170.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.37 35.72 9.32 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 124.637 1.113 . . . . 0.0 110.323 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 . . . . . 0 CA--C 1.523 -0.074 0 CA-C-O 121.477 0.656 . . . . 0.0 109.876 179.259 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 70.6 t -55.53 -43.16 71.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 174.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.66 -51.0 51.47 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.71 -52.9 63.5 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.61 0.764 . . . . 0.0 110.292 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.13 74.06 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.711 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -44.85 92.25 Favored 'General case' 0 C--O 1.224 -0.255 0 O-C-N 121.842 -0.536 . . . . 0.0 110.196 175.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.5 -54.29 5.68 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 124.827 1.203 . . . . 0.0 111.374 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -62.56 -50.99 69.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.638 0.375 . . . . 0.0 111.577 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.28 -25.49 36.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -169.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -142.81 -60.74 0.43 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.572 1.149 . . . . 0.0 110.782 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 154.05 139.34 2.82 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 107.021 -2.431 . . . . 0.0 107.021 -169.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -82.24 69.42 8.97 Favored 'General case' 0 C--N 1.337 0.044 0 CA-C-N 118.481 1.141 . . . . 0.0 110.376 -170.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -92.44 35.18 1.02 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.01 0.524 . . . . 0.0 110.441 170.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -134.43 -52.8 0.83 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 121.506 -0.746 . . . . 0.0 111.771 -167.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p 30.36 -98.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.267 2.227 . . . . 0.0 112.567 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tm0? -125.23 -59.96 1.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.807 1.643 . . . . 0.0 108.831 172.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.45 -58.31 7.96 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 123.937 0.895 . . . . 0.0 112.755 -167.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -41.64 99.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.729 0.695 . . . . 0.0 111.342 -177.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -57.59 -47.43 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.964 0.802 . . . . 0.0 110.871 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -63.05 -45.97 89.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.961 -0.462 . . . . 0.0 110.17 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -59.2 -40.43 85.75 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.629 0.772 . . . . 0.0 111.485 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -60.52 -55.46 33.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.153 0.581 . . . . 0.0 109.945 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -59.43 -39.22 82.83 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.645 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.09 -5.85 38.27 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 173.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.9 mt 58.52 42.39 21.0 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.707 2.003 . . . . 0.0 111.825 176.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -79.79 -31.51 40.81 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.846 0.858 . . . . 0.0 111.805 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.55 31.05 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.949 1.462 . . . . 0.0 114.949 -168.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 92.3 p 55.06 -80.54 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.515 2.326 . . . . 0.0 113.595 -178.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -174.74 -38.89 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.612 2.365 . . . . 0.0 109.335 -176.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -44.89 -52.18 8.88 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.616 1.166 . . . . 0.0 112.738 -174.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -76.73 -47.09 22.89 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.7 mtt -41.49 -46.9 3.61 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 125.184 1.394 . . . . 0.0 112.334 -177.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.5 t -61.42 -27.52 68.61 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -82.64 -51.19 7.97 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -45.1 -46.32 11.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.884 2.074 . . . . 0.0 111.799 -176.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -64.26 -64.02 3.23 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.99 -174.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.56 -37.46 96.99 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.476 1.451 . . . . 0.0 111.081 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.98 -56.93 12.31 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.231 0.612 . . . . 0.0 111.027 175.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.9 mt -67.88 -35.56 78.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.103 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.22 -49.75 75.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.834 0.743 . . . . 0.0 109.96 176.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -66.99 -42.01 85.78 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -52.21 -47.55 65.55 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 122.011 -0.43 . . . . 0.0 110.459 170.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -53.42 57.43 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -45.62 -53.56 9.01 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.89 0.876 . . . . 0.0 110.427 174.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.84 -45.71 91.33 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.79 -177.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.279 0 C-N-CA 123.736 0.814 . . . . 0.0 111.134 -176.75 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 N--CA 1.451 -0.389 0 CA-C-O 121.012 0.434 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp -40.14 -48.34 2.5 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.641 1.576 . . . . 0.0 111.35 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -53.97 -36.47 62.9 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.388 0.675 . . . . 0.0 112.558 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -79.87 -49.12 12.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.553 0.615 . . . . 0.0 109.443 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -51.78 -48.85 63.62 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.843 -0.599 . . . . 0.0 111.786 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -55.95 -62.71 1.52 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 118.801 0.728 . . . . 0.0 111.43 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -59.06 -43.62 91.73 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.612 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -56.0 -52.36 64.5 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 110.196 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -52.3 66.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.142 0.977 . . . . 0.0 110.327 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.66 -48.86 63.25 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.81 0.844 . . . . 0.0 109.884 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.6 m -62.29 -45.82 91.54 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.057 0.543 . . . . 0.0 110.64 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -54.91 -45.95 74.81 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.105 0.562 . . . . 0.0 109.568 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.9 -46.14 85.39 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.03 -0.419 . . . . 0.0 111.258 174.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -59.16 -46.79 87.46 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.248 0.931 . . . . 0.0 110.567 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -58.89 -46.45 87.82 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 122.184 -0.322 . . . . 0.0 110.518 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -55.17 -47.12 75.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.544 0.738 . . . . 0.0 110.948 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 81.9 mt -59.54 -46.96 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 123.109 0.563 . . . . 0.0 109.773 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -57.77 -42.02 83.21 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.468 0.576 . . . . 0.0 111.224 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -67.47 -15.66 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.24 33.04 72.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 -173.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -91.89 79.45 5.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 122.634 1.207 . . . . 0.0 109.091 -174.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 t -105.69 -178.03 3.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.666 1.986 . . . . 0.0 108.771 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 59.51 -71.87 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 127.585 2.354 . . . . 0.0 110.117 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -169.07 39.21 0.21 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 169.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -59.48 -49.8 76.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.946 1.373 . . . . 0.0 110.549 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.1 t -50.81 -50.44 23.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.267 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.83 -44.74 55.62 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.452 0.549 . . . . 0.0 112.389 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.41 -52.1 59.86 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 123.819 0.847 . . . . 0.0 110.396 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.33 -57.42 12.32 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.437 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 10.5 ttm -50.32 -42.49 52.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.546 1.138 . . . . 0.0 111.293 169.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.55 -54.28 6.61 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 124.721 1.153 . . . . 0.0 111.875 170.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -67.19 -49.08 65.92 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.61 0.364 . . . . 0.0 111.459 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.6 mt -71.66 -53.44 13.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.479 0.712 . . . . 0.0 112.49 -169.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -116.45 -58.18 2.11 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.836 1.654 . . . . 0.0 111.142 -169.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.35 152.38 7.61 Favored Glycine 0 CA--C 1.532 1.122 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 -171.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.63 60.91 1.73 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.283 1.433 . . . . 0.0 113.216 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -110.36 174.32 5.92 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.768 1.227 . . . . 0.0 108.029 172.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' HG12 ' A' ' 47' ' ' ILE . 74.9 m-85 66.7 39.88 3.46 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.379 1.072 . . . . 0.0 112.302 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -74.85 57.65 0.79 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.565 1.546 . . . . 0.0 109.855 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 72.53 -53.03 0.7 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.361 1.465 . . . . 0.0 111.25 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -41.66 -70.8 0.1 Allowed 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 127.761 2.424 . . . . 0.0 111.715 177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.96 -32.83 74.24 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.259 0.624 . . . . 0.0 111.461 -171.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.41 HG12 ' HB3' ' A' ' 42' ' ' PHE . 18.2 mm -60.52 -53.56 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 171.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -53.94 -48.37 70.31 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.999 -0.438 . . . . 0.0 110.535 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -56.71 -42.83 79.87 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.498 175.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -57.85 -55.52 33.8 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.876 0.47 . . . . 0.0 110.311 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -57.13 -38.03 72.87 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.551 176.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.28 -1.36 26.21 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.7 mp 51.26 30.58 5.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.231 1.813 . . . . 0.0 112.988 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -83.9 35.22 0.52 Allowed 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.897 -1.127 . . . . 0.0 111.004 -174.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.7 mt -139.86 19.66 2.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.666 1.586 . . . . 0.0 110.513 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.0 m 28.64 60.84 0.13 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.336 2.655 . . . . 0.0 116.029 169.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.2 t80 68.89 -58.59 0.49 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.51 1.924 . . . . 0.0 114.417 171.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -41.3 -56.0 2.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 113.262 -170.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -76.69 -49.69 15.5 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.565 0.698 . . . . 0.0 109.365 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 89.0 mtp -45.12 -44.8 10.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.602 1.561 . . . . 0.0 112.847 -173.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.9 t -59.77 -35.67 75.11 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.9 0.48 . . . . 0.0 112.112 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.5 mttp -79.38 -35.97 39.92 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.644 0.778 . . . . 0.0 110.066 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' C ' HD12 ' A' ' 63' ' ' LEU 0.266 0.0 OUTLIER -65.32 -45.3 84.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.074 0.95 . . . . 0.0 112.132 -178.087 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -44.67 -62.25 1.7 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.212 1.005 . . . . 0.0 113.434 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -60.28 -34.53 93.66 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 121.974 1.783 . . . . 0.0 112.33 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.1 -48.28 80.87 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 mt -64.24 -38.76 92.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 118.108 0.413 . . . . 0.0 111.507 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.09 -51.62 69.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.91 0.777 . . . . 0.0 109.881 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -60.93 -39.06 87.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.545 0.338 . . . . 0.0 110.162 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -56.98 -44.8 83.06 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 121.761 -0.587 . . . . 0.0 109.916 173.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -47.32 86.36 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.921 0.888 . . . . 0.0 109.426 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.96 -46.65 78.53 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.974 0.509 . . . . 0.0 110.915 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -67.37 -51.2 54.99 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.568 1.147 . . . . 0.0 112.204 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 41.09 48.78 3.0 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 128.29 2.636 . . . . 0.0 113.959 -174.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 169.748 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 120.52 0.2 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.9 mp -46.11 -40.66 11.26 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.154 1.382 . . . . 0.0 112.257 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -47.74 -40.6 20.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.66 0.784 . . . . 0.0 111.98 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.35 -43.84 93.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.893 -0.505 . . . . 0.0 109.806 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.98 -49.1 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.426 1.09 . . . . 0.0 110.328 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -54.6 44.55 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.145 0.884 . . . . 0.0 110.882 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -55.14 -51.05 67.7 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -54.88 -49.7 70.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.882 0.473 . . . . 0.0 110.974 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.9 -51.35 67.91 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 110.651 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -62.59 -42.7 99.72 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.936 -0.477 . . . . 0.0 110.725 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.8 m -61.02 -44.94 96.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.174 0.589 . . . . 0.0 110.258 176.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -55.71 -48.33 75.34 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.811 1.244 . . . . 0.0 109.042 176.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -55.31 -45.13 76.33 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.183 173.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -59.18 -49.43 77.88 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.226 0.921 . . . . 0.0 110.645 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -55.29 -47.01 76.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.012 -0.43 . . . . 0.0 110.694 176.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.3 ttp85 -57.8 -45.05 86.65 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 110.949 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.9 mt -61.99 -46.75 95.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 C-N-CA 123.385 0.674 . . . . 0.0 109.822 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.28 -41.01 78.93 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.801 0.728 . . . . 0.0 110.848 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.99 -13.43 62.45 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 173.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.54 29.37 72.91 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 123.891 0.758 . . . . 0.0 111.286 -177.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -97.17 143.74 27.68 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 117.448 0.624 . . . . 0.0 109.821 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.9 t -165.71 -178.48 4.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 50.38 -107.4 0.27 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.746 1.618 . . . . 0.0 111.094 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.61 10.67 28.06 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 118.625 -1.097 . . . . 0.0 112.514 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.09 -61.94 2.24 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 119.613 1.707 . . . . 0.0 109.157 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.67 -40.4 79.23 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-O 118.622 -0.704 . . . . 0.0 109.339 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.15 -57.44 6.3 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 174.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.4 tp -60.71 -43.27 98.04 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.561 0.744 . . . . 0.0 109.725 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.574 ' HB1' ' HE1' ' A' ' 70' ' ' TRP . . . -59.52 -37.51 78.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.381 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 31.2 mmm -65.99 -45.98 79.65 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -38.38 -51.05 2.33 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 126.813 2.149 . . . . 0.0 111.919 172.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -57.43 -40.31 78.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.0 mt -99.5 -53.87 3.09 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.671 0.388 . . . . 0.0 111.547 -169.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -112.58 -48.68 2.99 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.709 1.604 . . . . 0.0 110.908 -169.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.02 155.59 6.48 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 108.681 -1.768 . . . . 0.0 108.681 -169.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -76.96 68.27 3.1 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.119 0.96 . . . . 0.0 110.273 -173.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -85.2 -58.45 2.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.346 0.658 . . . . 0.0 109.714 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -93.27 89.84 6.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.999 -0.438 . . . . 0.0 111.868 -168.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 m -100.34 -179.24 4.06 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 169.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -51.25 -36.28 41.17 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.7 p -53.04 -73.59 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.795 0.838 . . . . 0.0 109.82 172.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -43.33 65.74 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.547 1.139 . . . . 0.0 111.807 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.77 -48.04 81.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 O-C-N 121.504 -0.747 . . . . 0.0 111.47 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.7 p -56.01 -45.14 79.17 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.395 -1.441 . . . . 0.0 110.201 174.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.69 -37.07 75.28 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.961 0.504 . . . . 0.0 111.915 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -58.88 -55.45 34.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.139 0.976 . . . . 0.0 110.012 173.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.15 -27.94 69.72 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.12 -4.34 56.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.5 0.72 . . . . 0.0 112.436 171.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp 53.96 31.44 13.47 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.071 2.148 . . . . 0.0 113.996 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -92.25 27.64 2.15 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.538 -0.726 . . . . 0.0 111.494 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 mt -128.85 31.06 5.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.901 1.68 . . . . 0.0 107.887 170.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 m -33.73 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 129.913 3.285 . . . . 0.0 114.704 -168.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 23.0 t80 68.65 -58.24 0.48 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.745 2.418 . . . . 0.0 113.323 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -43.14 -51.71 5.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.902 1.681 . . . . 0.0 113.074 -172.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -81.55 -48.32 11.95 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.9 mtt -43.84 -40.41 4.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 126.195 1.798 . . . . 0.0 112.761 -173.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.7 t -66.94 -23.37 65.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.085 -1.046 . . . . 0.0 113.063 -176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.62 -55.22 3.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.905 0.86 . . . . 0.0 108.701 169.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -48.02 -44.23 30.78 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.109 2.164 . . . . 0.0 112.294 -177.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -63.64 -62.95 4.53 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.436 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.55 -37.01 96.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.205 1.27 . . . . 0.0 111.881 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.0 -49.91 72.83 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.0 mt -61.88 -40.34 95.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.312 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -57.0 -53.7 55.12 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.78 0.718 . . . . 0.0 109.795 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -58.93 -46.02 88.98 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.679 0.392 . . . . 0.0 110.438 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.574 ' HE1' ' HB1' ' A' ' 33' ' ' ALA . 73.4 t90 -54.56 -45.09 73.42 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.479 0.312 . . . . 0.0 110.639 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.83 -44.44 85.55 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.01 -40.05 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.768 0.427 . . . . 0.0 110.503 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -71.69 -59.47 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.17 0.588 . . . . 0.0 111.488 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.82 69.8 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.266 1.026 . . . . 0.0 112.563 -169.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 . . . . . 0 N--CA 1.456 -0.162 0 C-N-CA 125.456 1.502 . . . . 0.0 112.251 -173.216 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.4 t70 . . . . . 0 N--CA 1.455 -0.223 0 CA-C-O 120.605 0.241 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.4 mp -50.66 -41.89 55.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.659 0.784 . . . . 0.0 111.394 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -53.86 -47.51 70.95 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.587 0.355 . . . . 0.0 110.967 173.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -65.55 -43.35 90.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.501 0.721 . . . . 0.0 110.053 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.14 -47.09 81.99 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.737 0.415 . . . . 0.0 110.404 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -56.63 18.96 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.546 0.738 . . . . 0.0 110.298 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -52.27 -54.18 34.51 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.738 0.815 . . . . 0.0 109.077 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -54.95 -49.92 70.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.634 0.774 . . . . 0.0 111.055 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.51 -52.97 60.28 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.159 0.89 . . . . 0.0 110.814 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -60.32 -38.69 84.49 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.49 -0.757 . . . . 0.0 111.132 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 85.7 m -65.2 -44.63 87.73 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.552 -0.717 . . . . 0.0 109.829 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -53.07 -54.06 41.05 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.807 1.243 . . . . 0.0 108.865 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.43 -52.33 62.12 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 177.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -56.65 -54.29 47.74 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.934 -0.479 . . . . 0.0 111.367 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -57.25 -48.32 79.16 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 122.094 -0.379 . . . . 0.0 110.528 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.7 ttp85 -50.79 -50.42 56.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.766 0.826 . . . . 0.0 110.569 176.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.78 -49.26 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 C-N-CA 122.979 0.512 . . . . 0.0 110.023 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -55.48 -42.41 74.32 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.82 0.737 . . . . 0.0 111.239 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.5 mt -68.54 -17.87 64.24 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.377 0.671 . . . . 0.0 112.075 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.93 25.7 75.16 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -87.44 92.41 9.07 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 122.096 0.95 . . . . 0.0 108.46 -176.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -51.82 159.52 0.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.17 1.388 . . . . 0.0 111.251 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -38.62 45.73 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.778 -0.576 . . . . 0.0 110.153 169.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.05 -57.42 16.64 Favored Glycine 0 CA--C 1.53 1.005 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 171.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -52.63 -53.02 52.6 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 117.454 0.627 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.87 -56.31 13.31 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.56 -48.77 34.74 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 123.811 0.72 . . . . 0.0 111.746 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.62 -54.86 29.22 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.451 0.643 . . . . 0.0 110.933 -177.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.63 -48.97 77.98 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.964 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -40.3 81.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.471 0.708 . . . . 0.0 110.413 174.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -46.88 -55.89 8.0 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 125.004 1.287 . . . . 0.0 111.112 169.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -61.42 -48.22 82.17 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -80.99 -28.93 35.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -145.16 -63.53 0.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 111.049 -172.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.87 140.52 3.34 Favored Glycine 0 CA--C 1.529 0.945 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 -169.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.28 61.06 5.31 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 122.112 -0.64 . . . . 0.0 111.351 -168.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -81.64 -151.86 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 64.4 31.9 12.35 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.422 -0.799 . . . . 0.0 112.085 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -76.77 54.2 0.97 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.078 1.751 . . . . 0.0 110.235 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 66.39 -67.36 0.15 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.983 1.713 . . . . 0.0 109.99 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.2 p -28.45 -73.4 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 128.16 2.584 . . . . 0.0 111.838 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.8 m -53.49 -37.85 63.12 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.373 1.869 . . . . 0.0 112.714 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.9 mm -75.02 -48.96 30.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 121.631 -0.668 . . . . 0.0 109.829 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.9 m -53.95 -48.77 69.94 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.587 -0.696 . . . . 0.0 110.652 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -58.52 -40.76 83.79 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.522 1.129 . . . . 0.0 110.936 176.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.461 ' CE2' HD12 ' A' ' 67' ' ' LEU . 4.2 t80 -57.56 -56.62 19.57 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.311 0.505 . . . . 0.0 110.31 175.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -65.55 -25.28 67.36 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.71 -5.13 44.17 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.058 0.845 . . . . 0.0 112.083 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 50.03 42.39 24.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.508 1.923 . . . . 0.0 111.552 -171.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -79.86 -34.68 39.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.78 0.832 . . . . 0.0 112.005 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.38 52.11 1.55 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.899 0.88 . . . . 0.0 111.931 -169.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 m -24.17 85.43 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.515 3.126 . . . . 0.0 116.757 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 t80 68.43 -57.76 0.48 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.759 2.424 . . . . 0.0 114.224 170.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -43.32 -50.98 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.198 1.799 . . . . 0.0 112.358 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -46.54 22.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.413 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 62.6 mtt -46.81 -44.91 19.68 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.913 1.285 . . . . 0.0 112.136 -172.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 22.2 t -64.39 -22.18 66.87 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -175.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.3 -51.91 5.32 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.063 0.935 . . . . 0.0 108.607 171.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 60' ' ' MET . 28.3 tp -47.1 -45.49 22.17 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 127.669 2.388 . . . . 0.0 112.041 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -63.66 -64.14 3.22 Favored Pre-proline 0 N--CA 1.453 -0.286 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.371 -176.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -56.28 -39.46 91.13 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 CA-C-N 120.87 1.346 . . . . 0.0 111.202 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tt -53.66 -57.7 9.85 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 123.005 0.522 . . . . 0.0 111.563 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 50' ' ' PHE . 83.2 mt -70.75 -31.18 67.91 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.151 0.58 . . . . 0.0 110.958 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.84 -46.17 89.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.73 -41.91 91.65 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.131 -0.356 . . . . 0.0 110.116 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -52.53 -46.73 66.85 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.156 0.434 . . . . 0.0 110.325 171.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.45 -46.78 86.97 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.11 -52.17 53.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.806 0.275 . . . . 0.0 110.638 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.79 -54.46 46.87 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.782 0.433 . . . . 0.0 111.709 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.52 -36.68 76.65 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.64 1.176 . . . . 0.0 111.652 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 CA--C 1.532 0.274 0 C-N-CA 126.908 2.083 . . . . 0.0 107.309 178.885 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 p30 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp -57.42 -43.26 83.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.017 0.527 . . . . 0.0 111.265 -174.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.31 -54.23 47.89 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.764 0.426 . . . . 0.0 109.966 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.97 -44.32 91.49 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.347 0.659 . . . . 0.0 110.95 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -57.93 -48.07 81.01 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.713 0.405 . . . . 0.0 110.712 176.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -55.84 29.79 Favored 'General case' 0 C--N 1.337 0.05 0 C-N-CA 123.134 0.574 . . . . 0.0 109.658 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -54.23 -51.91 63.0 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.67 0.388 . . . . 0.0 110.262 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -54.43 -53.76 49.89 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.452 0.701 . . . . 0.0 110.688 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.91 92.03 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.756 0.422 . . . . 0.0 111.114 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.5 ttpm? -56.36 -45.43 80.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.766 0.826 . . . . 0.0 109.798 174.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.3 m -63.57 -42.03 98.34 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.064 -0.397 . . . . 0.0 110.808 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -55.46 -51.1 68.06 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.35 -51.91 66.54 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.958 0.503 . . . . 0.0 110.85 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -45.97 88.73 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.745 -0.597 . . . . 0.0 110.421 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -65.98 -45.84 80.22 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.797 0.439 . . . . 0.0 109.848 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.4 ttp85 -50.58 -51.81 44.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 109.988 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 88.3 mt -59.42 -48.54 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.5 -42.46 78.38 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.4 0.546 . . . . 0.0 111.372 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.59 -16.23 63.79 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.7 0.8 . . . . 0.0 111.722 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.7 28.44 73.76 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -86.17 102.86 14.28 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -176.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -64.67 173.2 2.3 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.541 1.137 . . . . 0.0 111.718 -172.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mp0 -48.98 -48.91 42.95 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.855 1.262 . . . . 0.0 107.785 168.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.93 -55.7 26.61 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 124.595 1.093 . . . . 0.0 111.258 174.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.47 -58.25 7.8 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.036 0.918 . . . . 0.0 110.825 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.09 -48.38 89.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -176.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.92 -52.74 24.99 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 118.744 0.702 . . . . 0.0 111.659 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -61.11 -56.36 21.72 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.843 0.857 . . . . 0.0 110.46 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.73 -45.77 91.16 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.018 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mmm -55.51 -45.99 77.02 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 121.814 -0.554 . . . . 0.0 110.053 170.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.44 -57.08 4.55 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.754 1.168 . . . . 0.0 111.794 169.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -59.25 -50.5 73.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.787 0.293 . . . . 0.0 111.344 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.8 mt -78.14 -29.5 48.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -171.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -146.24 -61.4 0.31 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.127 0.971 . . . . 0.0 111.456 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 164.96 138.7 2.47 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 107.616 -2.193 . . . . 0.0 107.616 -169.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -78.73 38.87 0.33 Allowed 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.665 -0.903 . . . . 0.0 113.268 -168.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -81.38 41.75 0.63 Allowed 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.289 -0.882 . . . . 0.0 111.362 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -147.45 33.81 0.87 Allowed 'General case' 0 CA--C 1.524 -0.033 0 C-N-CA 124.094 0.958 . . . . 0.0 109.971 -169.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.6 m -73.07 64.58 0.73 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.814 1.246 . . . . 0.0 110.266 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 68.96 -60.56 0.45 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.413 1.885 . . . . 0.0 111.972 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 m -45.12 -66.3 0.42 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.9 1.28 . . . . 0.0 111.797 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.49 -41.07 69.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.267 1.027 . . . . 0.0 111.729 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.7 mm -64.73 -43.79 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.483 0.713 . . . . 0.0 109.991 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.6 p -65.42 -43.34 90.84 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.751 -0.593 . . . . 0.0 110.731 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -58.88 -45.94 89.02 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 118.51 0.596 . . . . 0.0 109.707 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -55.73 -57.95 9.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.254 1.022 . . . . 0.0 110.327 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -62.19 -34.99 77.5 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 -3.86 30.06 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 172.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 59.1 28.78 18.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.953 1.701 . . . . 0.0 111.926 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.35 -34.69 58.94 Favored 'General case' 0 C--N 1.333 -0.125 0 O-C-N 121.133 -0.98 . . . . 0.0 109.002 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 68.5 mt -62.98 -5.05 2.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 112.388 170.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.0 m 69.91 -65.16 0.32 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.722 1.609 . . . . 0.0 115.18 166.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -166.18 -53.28 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.826 0.739 . . . . 0.0 111.489 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -46.37 -51.54 14.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.924 0.889 . . . . 0.0 113.202 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -77.73 -52.15 9.4 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.6 mmm -38.04 -51.22 1.38 Allowed 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 126.338 1.855 . . . . 0.0 111.267 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 31.3 t -65.8 -29.28 69.74 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -84.63 -40.39 17.52 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.975 0.893 . . . . 0.0 108.978 175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -67.74 -35.02 77.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.844 1.257 . . . . 0.0 113.584 -176.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -50.33 -67.39 0.47 Allowed Pre-proline 0 CA--C 1.536 0.406 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.885 173.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -57.75 -37.03 98.01 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.907 1.738 . . . . 0.0 111.394 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tt -53.6 -55.38 26.27 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.611 0.764 . . . . 0.0 111.117 173.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.3 mt -66.71 -31.9 72.86 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.781 -0.574 . . . . 0.0 112.02 176.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.09 -47.71 78.98 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.573 -0.704 . . . . 0.0 109.254 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -64.2 -39.98 95.12 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 119.245 -0.407 . . . . 0.0 110.608 175.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 68.8 t90 -52.42 -49.1 65.21 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.459 0.572 . . . . 0.0 110.181 169.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.72 -47.48 85.07 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -175.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.81 -53.27 50.94 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.823 0.449 . . . . 0.0 110.69 175.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.82 -50.09 75.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.674 0.39 . . . . 0.0 111.41 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.58 -34.67 78.42 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.903 1.281 . . . . 0.0 111.449 -175.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 N--CA 1.453 -0.28 0 C-N-CA 125.021 1.328 . . . . 0.0 110.687 -179.273 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 . . . . . 0 CA--C 1.534 0.342 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mp -41.0 -53.41 2.98 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.882 1.673 . . . . 0.0 112.958 -169.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -52.48 -40.6 62.51 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.935 0.894 . . . . 0.0 111.902 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -70.58 -54.37 12.32 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.5 mt -52.25 -52.96 49.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 112.102 -171.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.18 -59.73 4.28 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.57 0.7 . . . . 0.0 111.588 -174.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -53.24 -60.22 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.411 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -50.6 -50.19 54.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.187 0.995 . . . . 0.0 111.35 -172.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.32 -53.24 60.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.556 0.693 . . . . 0.0 110.476 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -65.49 -22.74 66.76 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.66 -0.65 . . . . 0.0 111.542 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 57.6 m -75.96 -40.38 54.08 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.366 -0.834 . . . . 0.0 109.455 176.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.62 -48.44 72.21 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 170.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.2 tttp -54.38 -55.65 26.52 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.699 0.285 . . . . 0.0 111.671 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -57.41 -52.07 66.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.746 -0.596 . . . . 0.0 111.218 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpt85 -60.26 -44.67 95.08 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.161 0.584 . . . . 0.0 110.421 -178.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 58.9 ttp85 -52.72 -49.41 65.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.073 0.949 . . . . 0.0 110.482 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 75.1 mt -59.66 -46.87 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-O 119.128 -0.463 . . . . 0.0 110.059 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -57.02 -42.12 79.82 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.085 0.857 . . . . 0.0 111.299 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.24 -18.42 65.34 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.741 0.416 . . . . 0.0 112.086 174.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.09 24.43 74.6 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 -172.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -85.67 92.97 8.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 122.609 1.195 . . . . 0.0 108.492 -175.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.8 t -62.12 167.71 3.79 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.987 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.81 -53.9 4.38 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.73 1.212 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -51.34 -47.52 50.35 Favored Glycine 0 CA--C 1.529 0.965 0 C-N-CA 124.267 0.937 . . . . 0.0 112.818 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -63.45 -52.12 62.79 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.423 1.111 . . . . 0.0 109.507 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.4 t -57.74 -52.43 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.22 -48.51 47.0 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.39 -56.92 15.19 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 117.494 0.647 . . . . 0.0 110.167 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.401 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.03 -46.22 90.22 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.894 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -47.02 60.99 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.957 1.303 . . . . 0.0 109.41 170.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -48.8 -59.15 6.95 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.943 1.259 . . . . 0.0 112.307 169.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.25 -47.81 77.79 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 117.06 0.43 . . . . 0.0 111.409 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.1 mt -73.5 -50.35 21.96 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 5.9 m-85 -126.3 -59.05 1.33 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.938 0.895 . . . . 0.0 112.0 -168.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 158.55 135.1 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -169.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -82.39 73.6 9.41 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.699 -0.883 . . . . 0.0 110.331 -170.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.79 27.67 2.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.311 167.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -148.13 47.17 1.07 Allowed 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.852 -0.53 . . . . 0.0 110.403 -167.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.2 p -60.04 -59.88 4.71 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.921 0.888 . . . . 0.0 109.154 175.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -159.29 -54.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.062 1.345 . . . . 0.0 109.029 -177.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.0 p -48.69 -69.74 0.11 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.414 1.485 . . . . 0.0 111.023 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.2 m -49.12 -49.14 43.48 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.22 1.408 . . . . 0.0 111.363 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.6 mm -60.21 -47.8 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.993 0.917 . . . . 0.0 110.533 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m -62.59 -48.19 80.54 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.205 -0.309 . . . . 0.0 110.475 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -36.88 82.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.284 0.634 . . . . 0.0 110.925 178.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -63.6 -52.28 61.61 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 118.671 0.669 . . . . 0.0 110.639 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -58.22 -33.25 69.11 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.661 0.784 . . . . 0.0 112.082 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.47 8.89 22.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.066 0.946 . . . . 0.0 112.373 172.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.5 mp 36.83 44.88 0.38 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.64 2.376 . . . . 0.0 113.459 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -85.52 -53.05 5.43 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.713 1.205 . . . . 0.0 108.955 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.87 101.61 0.22 Allowed 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.11 -179.89 1.36 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.053 1.741 . . . . 0.0 114.357 -167.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -40.53 -46.79 2.56 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.825 1.65 . . . . 0.0 113.906 -169.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -41.46 -46.16 3.37 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.249 1.42 . . . . 0.0 112.555 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -79.02 -58.43 3.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.69 0.796 . . . . 0.0 108.886 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 41.4 mtt -44.95 -49.89 10.86 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.785 1.234 . . . . 0.0 112.117 -170.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.4 t -66.19 -36.95 84.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.629 -169.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -74.01 -43.18 58.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.498 0.666 . . . . 0.0 109.677 172.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.3 tp -64.64 -46.5 82.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.864 0.866 . . . . 0.0 112.003 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -52.33 -56.55 21.27 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.961 -173.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.06 -36.51 89.07 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 CA-C-N 121.247 1.481 . . . . 0.0 111.824 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.407 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.4 mp -61.21 -52.08 66.29 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -63.14 -38.9 93.0 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.349 0.66 . . . . 0.0 111.341 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -58.74 -51.94 67.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -64.08 -40.05 95.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.282 -0.261 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.401 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 54.4 t90 -53.78 -46.72 71.11 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 172.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.64 -46.23 80.03 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.89 -51.81 59.82 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.016 0.526 . . . . 0.0 110.906 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -58.73 -50.95 72.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.359 0.664 . . . . 0.0 111.099 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.19 96.41 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.022 0.929 . . . . 0.0 111.382 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 N--CA 1.453 -0.286 0 C-N-CA 125.922 1.689 . . . . 0.0 111.24 -176.036 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.122 0.487 . . . . 0.0 110.39 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -66.38 -8.1 23.43 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -169.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -54.49 -36.98 64.74 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.053 -1.029 . . . . 0.0 109.49 168.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -61.96 -50.26 72.83 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.283 0.633 . . . . 0.0 109.741 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -55.69 -43.39 76.38 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 124.358 1.063 . . . . 0.0 109.688 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -55.48 22.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.592 0.757 . . . . 0.0 109.397 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -54.08 -56.23 20.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -50.63 -54.11 25.44 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.184 0.594 . . . . 0.0 110.992 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.74 -50.38 73.7 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.785 -0.572 . . . . 0.0 110.475 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -28.02 68.76 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.73 -0.606 . . . . 0.0 111.384 176.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 90.1 m -70.92 -45.47 64.19 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -55.04 -44.31 74.56 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.728 0.411 . . . . 0.0 110.08 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -55.97 -54.1 48.88 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.99 -0.444 . . . . 0.0 110.741 174.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -55.1 -46.33 75.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.995 -0.441 . . . . 0.0 111.002 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -53.44 -50.68 64.75 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.186 0.448 . . . . 0.0 110.298 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -54.34 -48.01 71.88 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.559 0.618 . . . . 0.0 111.658 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.39 -54.86 20.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 118.399 0.545 . . . . 0.0 109.724 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -55.52 -43.85 76.09 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.082 0.401 . . . . 0.0 111.148 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.05 -14.25 60.21 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.355 0.662 . . . . 0.0 112.279 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.16 34.88 87.53 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -173.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -90.13 92.17 8.85 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 122.146 0.974 . . . . 0.0 110.182 -176.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.6 t -124.83 -171.59 2.39 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.144 2.178 . . . . 0.0 107.96 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 57.95 -72.21 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.553 2.741 . . . . 0.0 111.284 -177.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -173.43 39.37 0.14 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 170.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -57.5 -55.77 30.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.522 1.161 . . . . 0.0 109.654 177.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.7 t -50.39 -49.61 23.44 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.992 171.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.9 -46.33 32.11 Favored Glycine 0 CA--C 1.527 0.809 0 C-N-CA 123.816 0.722 . . . . 0.0 113.75 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.3 -50.89 68.3 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.28 1.04 . . . . 0.0 110.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.424 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -60.93 -52.42 65.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.158 -178.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -37.96 58.29 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.886 1.274 . . . . 0.0 109.772 169.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -49.72 -59.83 6.98 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 125.612 1.577 . . . . 0.0 111.16 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -62.84 -39.91 95.83 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.517 0.198 . . . . 0.0 111.306 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.0 tp -84.87 -23.91 28.77 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -168.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -148.96 -65.19 0.23 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.398 1.879 . . . . 0.0 110.601 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 177.27 139.95 3.49 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 -169.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.7 62.46 5.54 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 117.521 0.661 . . . . 0.0 112.355 -167.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -92.24 -155.04 0.4 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.44 40.44 20.76 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 120.843 -1.161 . . . . 0.0 113.894 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -75.51 50.48 0.54 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.092 1.357 . . . . 0.0 108.901 169.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 67.29 -42.28 0.43 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.182 1.793 . . . . 0.0 112.023 -167.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -42.26 -70.49 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.955 2.102 . . . . 0.0 113.216 -173.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 p -65.41 -40.46 93.41 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.54 -0.725 . . . . 0.0 110.409 -174.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.1 mm -54.37 -41.31 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.167 0.987 . . . . 0.0 110.712 173.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.5 m -68.62 -48.37 64.25 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.482 -0.761 . . . . 0.0 109.782 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -58.81 -33.65 70.62 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.756 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.18 -52.29 36.12 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 126.216 1.806 . . . . 0.0 110.531 174.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -60.6 -23.8 64.98 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.62 0.768 . . . . 0.0 112.455 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.03 -6.32 55.67 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 0.0 112.463 169.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.77 41.15 32.13 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 127.075 2.15 . . . . 0.0 112.095 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -100.29 -7.18 24.85 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.8 mt -83.73 50.53 1.82 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.753 1.16 . . . . 0.0 111.176 -175.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 42.62 31.23 0.28 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.897 2.879 . . . . 0.0 116.038 170.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 t80 67.84 -50.81 0.52 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.21 1.804 . . . . 0.0 113.019 -174.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -38.45 -53.46 1.54 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.593 1.957 . . . . 0.0 112.786 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.88 -49.02 19.09 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 mtp -47.78 -47.2 30.81 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.626 1.571 . . . . 0.0 110.699 -174.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.5 t -59.17 -34.37 72.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.688 0.795 . . . . 0.0 113.106 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -85.37 -36.03 21.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.007 0.908 . . . . 0.0 110.124 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -62.93 -38.74 92.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.223 1.009 . . . . 0.0 110.661 -178.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -53.04 -64.08 1.9 Allowed Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.797 176.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -58.46 -39.02 87.37 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.027 1.818 . . . . 0.0 111.679 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -53.18 -52.58 58.35 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.877 0.762 . . . . 0.0 111.182 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.8 mt -69.35 -36.52 76.95 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.706 -0.621 . . . . 0.0 111.99 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -57.56 -49.76 75.33 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.835 0.743 . . . . 0.0 109.045 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -63.74 -42.24 97.91 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.529 0.332 . . . . 0.0 110.137 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.424 ' HE1' ' HB3' ' A' ' 33' ' ' ALA . 71.5 t90 -52.84 -47.04 68.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.217 0.462 . . . . 0.0 110.585 170.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -51.12 70.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -47.53 74.33 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.044 0.538 . . . . 0.0 110.335 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -59.13 -52.88 63.8 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.437 0.695 . . . . 0.0 110.575 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.51 -48.62 74.36 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.219 0.607 . . . . 0.0 110.181 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.883 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 t70 . . . . . 0 N--CA 1.451 -0.42 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.91 -15.19 28.43 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.149 0.431 . . . . 0.0 111.504 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -48.99 -47.71 44.04 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.387 1.075 . . . . 0.0 110.855 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -57.53 -45.86 84.53 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.349 0.26 . . . . 0.0 110.988 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.53 -53.12 61.31 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 124.573 1.149 . . . . 0.0 110.832 -175.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -57.66 11.83 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.216 0.462 . . . . 0.0 110.581 -177.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -54.93 -49.48 71.22 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -55.44 -50.61 69.37 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.341 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.72 -51.9 64.16 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.348 0.976 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp -59.77 -38.38 81.69 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.0 m -64.9 -44.7 88.72 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 121.706 -0.622 . . . . 0.0 109.78 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.52 -48.76 68.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.736 1.214 . . . . 0.0 109.544 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.95 -45.49 92.46 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 174.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.11 -45.35 83.5 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.013 -1.054 . . . . 0.0 111.247 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -60.95 -44.58 97.07 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 121.547 -0.721 . . . . 0.0 110.576 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -50.09 -48.97 52.95 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.657 0.783 . . . . 0.0 110.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -61.25 -51.26 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 122.951 0.5 . . . . 0.0 110.047 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -56.44 -41.39 76.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.892 0.769 . . . . 0.0 112.228 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.88 -12.06 61.19 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.698 0.799 . . . . 0.0 111.752 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.79 33.39 87.12 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -173.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -79.27 116.35 19.47 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 58.8 p -81.16 58.23 3.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.858 1.263 . . . . 0.0 110.071 -168.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 54.27 -75.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.75 2.42 . . . . 0.0 112.788 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -52.93 -27.73 30.23 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.374 0.988 . . . . 0.0 112.22 175.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -54.02 -40.33 66.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.568 0.684 . . . . 0.0 111.117 173.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -58.43 -52.22 61.92 Favored 'Isoleucine or valine' 0 C--N 1.342 0.244 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 172.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.96 -50.54 15.19 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 123.454 0.549 . . . . 0.0 111.885 174.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.7 tp -59.51 -57.57 12.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 117.723 0.762 . . . . 0.0 111.107 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.35 97.29 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.103 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.413 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 66.9 mmm -55.34 -44.1 75.6 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.762 -0.586 . . . . 0.0 110.052 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.76 -57.83 5.1 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 124.728 1.156 . . . . 0.0 111.299 169.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -57.44 -50.17 73.88 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 35.2 mt -83.37 -25.61 31.23 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -169.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -145.88 -61.37 0.33 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.55 1.14 . . . . 0.0 111.046 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 166.11 137.48 2.22 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 107.641 -2.184 . . . . 0.0 107.641 -169.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.07 36.44 0.23 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -167.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -83.33 38.51 0.61 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.096 -1.003 . . . . 0.0 111.414 -172.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -152.75 42.79 0.63 Allowed 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 124.377 1.071 . . . . 0.0 109.671 -169.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 p -56.2 -62.05 1.97 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 170.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -154.43 -47.64 0.09 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.474 1.11 . . . . 0.0 111.106 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -47.66 -67.07 0.31 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.969 1.308 . . . . 0.0 114.295 -169.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 12.5 p -56.79 -49.43 75.35 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.047 0.939 . . . . 0.0 110.341 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.4 mm -53.89 -47.74 63.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.753 1.221 . . . . 0.0 110.909 176.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.9 m -60.02 -48.17 82.81 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.226 -0.921 . . . . 0.0 110.121 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -59.11 -31.15 68.66 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.165 0.586 . . . . 0.0 111.298 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.62 -57.62 7.7 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 124.092 0.957 . . . . 0.0 110.051 174.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.33 -26.45 68.77 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.87 -6.92 59.24 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.665 0.666 . . . . 0.0 112.428 171.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.9 mp 48.03 49.39 17.26 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.706 2.003 . . . . 0.0 113.082 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.0 -32.1 27.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.657 0.783 . . . . 0.0 110.678 174.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 42.0 mt -81.18 46.17 0.9 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.825 0.85 . . . . 0.0 112.511 -168.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 m -21.93 85.35 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 129.28 3.032 . . . . 0.0 116.568 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.3 t80 69.25 -57.37 0.53 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.352 2.261 . . . . 0.0 114.025 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -46.09 -51.54 13.67 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.465 1.506 . . . . 0.0 112.519 -172.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -46.47 30.27 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtt -46.95 -44.37 19.93 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.944 1.298 . . . . 0.0 111.715 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.3 t -60.72 -29.82 69.59 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -84.49 -47.49 10.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.273 1.035 . . . . 0.0 109.245 172.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.1 -40.58 70.59 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.164 1.786 . . . . 0.0 111.764 -175.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -60.58 -66.9 1.25 Allowed Pre-proline 0 CA--C 1.536 0.414 0 CA-C-O 117.995 -1.003 . . . . 0.0 111.039 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.61 -40.14 80.35 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.193 1.929 . . . . 0.0 111.726 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.04 -57.02 11.79 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.255 0.622 . . . . 0.0 111.299 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.1 mt -69.53 -35.0 75.05 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -58.71 -49.81 76.22 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.996 0.816 . . . . 0.0 110.131 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -44.94 90.65 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.413 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 76.7 t90 -50.96 -48.82 60.92 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.165 -0.335 . . . . 0.0 110.843 172.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mt -61.19 -51.86 67.23 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.78 -46.01 74.36 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.768 0.427 . . . . 0.0 110.316 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.66 -53.08 61.82 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.113 0.565 . . . . 0.0 110.489 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.63 73.29 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.227 0.611 . . . . 0.0 110.204 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.675 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 110.602 -0.147 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -45.4 -39.96 7.55 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.35 1.46 . . . . 0.0 112.239 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -45.46 -47.59 13.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.004 0.922 . . . . 0.0 111.255 174.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.41 -47.31 84.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -52.22 60.66 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.222 1.009 . . . . 0.0 111.572 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -53.35 57.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.511 1.051 . . . . 0.0 110.974 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -59.88 -40.88 90.21 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.881 -0.512 . . . . 0.0 110.93 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -54.4 -51.17 65.7 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 121.717 -0.614 . . . . 0.0 109.98 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.64 -46.89 77.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.728 0.694 . . . . 0.0 111.821 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.2 -40.91 82.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.311 0.576 . . . . 0.0 111.036 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.7 m -63.28 -43.85 96.73 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.49 -0.756 . . . . 0.0 109.668 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -60.94 -45.22 95.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.551 1.141 . . . . 0.0 110.174 -177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -49.14 -52.16 27.94 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.143 0.429 . . . . 0.0 110.262 170.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -59.83 -50.87 72.11 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.797 -0.564 . . . . 0.0 111.257 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -55.85 -48.83 74.82 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.559 0.618 . . . . 0.0 110.59 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.3 ttp85 -52.84 -47.61 67.62 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 110.61 176.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 67.2 mt -60.11 -46.58 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.14 -0.457 . . . . 0.0 110.116 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -58.2 -40.88 82.7 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.191 0.905 . . . . 0.0 111.276 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.23 -13.1 59.79 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.933 -0.479 . . . . 0.0 112.112 173.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.87 27.74 73.59 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -88.99 113.59 24.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -174.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.4 p -77.52 35.55 0.19 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.933 1.693 . . . . 0.0 112.986 -168.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 63.08 -57.97 0.16 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.641 1.976 . . . . 0.0 112.267 -172.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -45.99 -41.45 10.76 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.016 0.817 . . . . 0.0 111.802 170.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -54.71 -51.48 65.46 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 117.507 0.654 . . . . 0.0 110.889 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.1 t -57.7 -45.34 86.75 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.96 -51.18 25.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 123.686 0.66 . . . . 0.0 112.226 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.54 -50.96 65.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.97 0.908 . . . . 0.0 110.85 -178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.56 -47.63 79.06 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.534 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 66.3 mmm -55.13 -47.41 75.09 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.075 0.95 . . . . 0.0 110.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.57 -53.29 3.61 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.212 1.387 . . . . 0.0 111.472 170.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -66.08 -55.05 18.46 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -75.29 -34.58 61.32 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -168.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -133.32 -56.59 0.91 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.422 1.089 . . . . 0.0 110.864 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.67 152.54 6.93 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 107.609 -2.197 . . . . 0.0 107.609 -170.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.05 65.77 5.32 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.169 0.985 . . . . 0.0 111.71 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -92.04 177.91 6.03 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.99 -1.855 . . . . 0.0 105.99 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 70.81 21.35 5.18 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.041 0.937 . . . . 0.0 112.882 168.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.3 m -75.01 73.06 2.19 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 169.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 72.41 -69.62 0.18 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 126.517 1.927 . . . . 0.0 112.312 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -46.4 -60.41 2.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.834 1.254 . . . . 0.0 112.159 -168.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.5 m -60.5 -31.55 70.58 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.605 0.762 . . . . 0.0 112.595 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -73.89 -40.8 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 119.013 0.824 . . . . 0.0 109.626 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.0 t -58.94 -53.59 56.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 171.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -58.29 -42.64 87.04 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.486 0.715 . . . . 0.0 111.261 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.1 -62.36 1.68 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 124.294 1.038 . . . . 0.0 109.95 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -62.7 -35.89 81.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.507 -174.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.63 -8.68 44.29 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.43 40.08 27.6 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.998 1.319 . . . . 0.0 110.559 -173.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -79.8 -32.79 40.79 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.574 0.75 . . . . 0.0 110.361 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 mt -81.24 45.19 0.83 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.556 0.742 . . . . 0.0 110.828 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.6 m -15.54 77.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 130.311 3.444 . . . . 0.0 116.763 -169.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.0 t80 69.22 -57.11 0.53 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.501 1.92 . . . . 0.0 114.249 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -39.04 -55.61 1.55 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.712 2.005 . . . . 0.0 113.363 -174.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -73.85 -52.67 12.24 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 122.07 0.938 . . . . 0.0 108.601 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.8 mtp -48.37 -38.57 19.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.537 1.535 . . . . 0.0 113.593 -170.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.78 -30.39 71.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -83.14 -42.28 17.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.607 0.718 . . . . 0.0 109.459 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.262 0.1 OUTLIER -62.86 -37.94 88.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.608 0.763 . . . . 0.0 112.407 -172.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -54.6 -67.21 0.7 Allowed Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.959 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.45 -41.58 74.65 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.328 2.019 . . . . 0.0 111.421 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.468 ' C ' HD23 ' A' ' 66' ' ' LEU . 2.4 tt -50.26 -49.86 51.92 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.935 0.494 . . . . 0.0 111.274 171.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 67' ' ' LEU . 11.7 mt -67.65 -42.66 81.9 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 118.953 0.797 . . . . 0.0 111.77 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -55.52 -48.55 74.48 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -62.9 -44.78 95.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.762 0.425 . . . . 0.0 110.843 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -52.53 -49.41 64.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.429 0.559 . . . . 0.0 110.264 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.4 -47.78 77.88 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.986 0.914 . . . . 0.0 109.012 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -50.86 -56.75 10.77 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.134 0.492 . . . . 0.0 110.547 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -60.4 -42.96 97.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.52 0.728 . . . . 0.0 110.217 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -88.83 31.88 0.83 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.133 0.973 . . . . 0.0 111.187 174.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 123.949 0.9 . . . . 0.0 110.83 -176.264 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp -53.01 -40.89 64.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.011 0.524 . . . . 0.0 111.508 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.0 tm-20 -57.06 -57.08 14.14 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.66 -38.81 92.52 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 119.717 -0.182 . . . . 0.0 111.297 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.8 mt -58.48 -44.79 89.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.073 173.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.88 -52.18 64.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.197 0.908 . . . . 0.0 108.932 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.46 -53.89 48.15 Favored 'General case' 0 CA--C 1.529 0.135 0 O-C-N 122.146 -0.346 . . . . 0.0 110.147 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -52.08 -49.13 64.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.945 1.298 . . . . 0.0 110.351 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.53 -51.87 68.05 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.309 0.644 . . . . 0.0 111.173 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -57.21 -45.77 83.53 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.721 0.772 . . . . 0.0 110.005 175.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 m -61.01 -31.51 71.13 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.73 -0.606 . . . . 0.0 110.164 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -62.24 -28.96 70.06 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.308 -0.87 . . . . 0.0 110.987 175.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -65.48 -50.54 64.97 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 121.406 -0.809 . . . . 0.0 110.016 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -58.65 -40.88 84.73 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.954 -0.466 . . . . 0.0 110.496 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.4 mtm180 -67.28 -43.49 81.65 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.401 0.68 . . . . 0.0 110.862 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 42.9 mtm180 -49.27 -55.56 12.27 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.08 0.855 . . . . 0.0 109.895 169.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.72 -50.77 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -54.54 -44.6 73.0 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.249 0.62 . . . . 0.0 111.48 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.0 -9.19 58.03 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.04 29.29 74.37 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.067 0.849 . . . . 0.0 111.124 -171.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -96.14 166.18 11.87 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.591 1.156 . . . . 0.0 109.821 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.2 t -146.34 176.62 9.64 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -57.59 -50.71 72.24 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.49 1.116 . . . . 0.0 111.248 -168.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.21 -45.73 92.36 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -65.16 -44.87 87.12 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.81 0.444 . . . . 0.0 110.03 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.08 -48.47 78.92 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 171.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.67 -54.59 8.87 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.781 0.705 . . . . 0.0 111.423 173.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 tp -60.4 -54.85 40.69 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.645 0.778 . . . . 0.0 111.054 -177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.13 -47.14 84.21 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.758 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -43.6 83.79 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.84 -0.537 . . . . 0.0 109.962 173.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.93 -55.7 6.22 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.827 1.203 . . . . 0.0 111.35 169.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.26 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 40.8 mt -85.66 -25.02 26.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -169.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -143.88 -64.52 0.37 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.117 1.367 . . . . 0.0 110.72 -174.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.97 143.06 3.71 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -171.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.18 71.95 8.18 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -172.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -107.48 26.91 9.67 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.528 0.731 . . . . 0.0 111.865 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -142.75 21.95 1.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -169.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 59.2 m -68.85 84.88 0.32 Allowed 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 169.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.282 4.2 pm0 58.25 -62.89 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 129.507 3.123 . . . . 0.0 113.806 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.3 m -33.46 -70.72 0.07 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.092 2.557 . . . . 0.0 112.953 -175.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 m -59.27 -38.76 80.89 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.091 1.357 . . . . 0.0 112.408 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.38 -35.51 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 122.977 0.511 . . . . 0.0 110.086 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -65.94 -50.41 64.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -56.25 -36.9 69.07 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.745 0.818 . . . . 0.0 111.278 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -60.36 -59.53 5.25 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.865 0.866 . . . . 0.0 110.054 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -56.42 -41.17 75.93 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.499 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.36 -3.45 24.06 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . 0.289 0.6 OUTLIER 40.56 51.82 2.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 127.236 2.214 . . . . 0.0 113.175 -170.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -79.39 -43.79 22.73 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.384 1.074 . . . . 0.0 110.838 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -80.22 58.65 3.1 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.699 0.8 . . . . 0.0 110.623 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.1 m -27.56 91.97 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 129.262 3.025 . . . . 0.0 116.121 -171.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 53.2 t80 67.49 -58.68 0.42 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.252 2.221 . . . . 0.0 114.63 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -44.13 -50.55 8.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.571 1.548 . . . . 0.0 112.56 -173.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.4 -54.51 12.13 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.694 0.759 . . . . 0.0 109.287 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.02 -43.41 19.53 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.669 1.588 . . . . 0.0 112.478 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.46 -32.36 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -83.5 -44.02 15.15 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.721 0.772 . . . . 0.0 109.262 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.5 tp -57.42 -42.16 81.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.278 1.031 . . . . 0.0 112.099 -176.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -58.68 -61.51 7.55 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.41 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -58.95 -38.77 86.28 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.721 1.614 . . . . 0.0 111.251 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tt -53.14 -54.13 40.28 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.865 0.757 . . . . 0.0 111.402 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.79 -39.12 87.66 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.797 0.439 . . . . 0.0 111.333 177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -58.69 -47.35 84.81 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.547 0.612 . . . . 0.0 109.856 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -64.31 -45.69 86.85 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.09 0.556 . . . . 0.0 110.143 177.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -50.95 -48.02 60.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.645 0.26 . . . . 0.0 110.425 173.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -51.41 69.93 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.422 1.089 . . . . 0.0 109.426 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -45.69 77.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.99 -54.6 35.76 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.85 76.17 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.293 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 CA--C 1.533 0.295 0 CA-C-O 121.161 0.505 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.9 mt -52.44 -40.66 62.48 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.442 0.697 . . . . 0.0 112.327 -176.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.77 -39.65 52.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.563 0.745 . . . . 0.0 111.687 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -79.52 -48.08 14.48 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -53.13 -46.99 69.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.462 0.705 . . . . 0.0 111.71 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.09 -60.06 4.15 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.069 0.85 . . . . 0.0 111.658 -176.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -48.29 -52.05 23.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.862 175.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -54.46 -51.23 65.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.034 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.23 -52.71 63.45 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.84 0.746 . . . . 0.0 110.69 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -57.04 -46.41 82.44 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.574 0.702 . . . . 0.0 110.711 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.5 m -60.56 -39.76 89.13 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 123.112 0.565 . . . . 0.0 110.274 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -58.62 -49.15 78.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.934 0.893 . . . . 0.0 109.196 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -56.49 -52.74 63.59 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 122.446 -0.159 . . . . 0.0 110.908 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -52.74 -53.48 47.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.779 0.432 . . . . 0.0 110.666 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -54.63 -54.01 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.77 0.828 . . . . 0.0 110.187 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.0 ptt85 -63.19 -36.8 84.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.987 -0.446 . . . . 0.0 110.985 -174.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 73.8 mt -55.2 -56.03 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 170.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -55.13 -41.31 71.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.131 0.423 . . . . 0.0 111.683 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.6 mt -73.1 -14.7 61.44 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.76 20.61 77.59 Favored Glycine 0 CA--C 1.533 1.157 0 O-C-N 121.343 -0.848 . . . . 0.0 111.368 -170.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -86.19 74.5 10.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.481 1.134 . . . . 0.0 109.272 -176.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 t -146.16 -168.84 3.1 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.036 -1.438 . . . . 0.0 109.677 -173.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 64.73 -66.45 0.13 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 128.047 2.539 . . . . 0.0 111.018 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.17 -6.13 0.4 Allowed Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.366 0.984 . . . . 0.0 113.122 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.03 -56.98 12.89 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 119.069 1.435 . . . . 0.0 111.273 -171.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 ' CZ2' ' A' ' 70' ' ' TRP . 94.0 t -58.23 -50.37 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -53.76 10.84 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 175.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.18 -52.82 52.62 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.545 0.738 . . . . 0.0 111.018 -174.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HE1' ' A' ' 70' ' ' TRP . . . -58.82 -47.71 83.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.455 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.57 85.41 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 121.978 -0.451 . . . . 0.0 109.916 173.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.72 -56.55 4.97 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 125.218 1.39 . . . . 0.0 111.131 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -61.88 -51.77 66.83 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 87.5 mt -77.12 -29.11 54.61 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -168.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -143.51 -63.34 0.4 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.491 1.517 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.12 145.75 4.74 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.63 71.08 7.49 Favored 'General case' 0 N--CA 1.461 0.115 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -172.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -107.69 19.96 19.46 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.597 0.759 . . . . 0.0 111.9 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -143.63 33.02 1.28 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -168.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.4 m -72.2 75.05 0.97 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 169.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 68.07 -62.22 0.36 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 127.589 2.356 . . . . 0.0 112.765 172.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -30.33 -77.85 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 128.319 2.648 . . . . 0.0 113.104 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 m -55.62 -38.21 69.2 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.791 0.836 . . . . 0.0 111.938 -174.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -66.74 -44.43 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 m -57.59 -43.71 84.86 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.065 -1.022 . . . . 0.0 109.629 172.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -64.57 -33.06 75.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.184 0.993 . . . . 0.0 111.901 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -63.37 -53.66 49.09 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 109.659 172.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -37.23 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.81 -14.92 63.21 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.057 -0.402 . . . . 0.0 111.827 171.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.0 mt 59.59 42.96 16.51 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.611 1.964 . . . . 0.0 111.604 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -78.5 -31.62 47.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.836 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.78 5.12 0.23 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -169.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.6 m 40.4 58.94 2.19 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.073 1.749 . . . . 0.0 114.549 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.2 t80 68.41 -58.08 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.008 2.123 . . . . 0.0 114.529 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -47.14 -51.45 18.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.864 1.266 . . . . 0.0 112.885 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.2 -43.38 42.69 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.8 mtt -46.82 -45.24 19.98 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 124.54 1.136 . . . . 0.0 111.421 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 t -60.83 -29.31 69.41 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 -177.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -83.09 -45.98 13.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.993 0.902 . . . . 0.0 109.387 171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -56.04 -44.28 78.66 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.932 1.693 . . . . 0.0 111.963 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -60.95 -59.92 12.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.516 -0.755 . . . . 0.0 111.785 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -58.6 -41.21 66.54 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.421 1.414 . . . . 0.0 111.217 175.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -49.99 -54.35 20.61 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 175.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.7 mt -68.93 -35.31 76.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.773 -0.579 . . . . 0.0 111.565 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -56.66 -50.05 73.23 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.409 0.55 . . . . 0.0 109.597 174.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -60.5 -49.04 79.14 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.921 0.489 . . . . 0.0 110.02 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.408 ' CZ2' HG22 ' A' ' 30' ' ' VAL . 67.6 t90 -49.23 -50.01 40.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.033 0.379 . . . . 0.0 111.009 174.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -48.48 75.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -175.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.32 -42.64 74.01 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 123.075 0.55 . . . . 0.0 111.139 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.52 -51.35 57.59 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.423 0.289 . . . . 0.0 111.116 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.48 -53.26 11.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.735 0.814 . . . . 0.0 112.163 -169.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 125.238 1.415 . . . . 0.0 111.951 -169.93 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp -49.86 -37.2 29.94 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.613 1.165 . . . . 0.0 110.807 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 55.5 mp0 -49.54 -40.12 36.97 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.566 1.546 . . . . 0.0 111.594 175.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.97 -49.98 14.24 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.9 mt -59.25 -44.88 92.36 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.885 0.474 . . . . 0.0 111.593 -172.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -64.86 -56.78 11.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.237 0.542 . . . . 0.0 111.0 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -48.46 -54.55 13.76 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.892 1.277 . . . . 0.0 110.293 172.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -51.45 -53.14 40.11 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.62 -52.1 60.96 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.548 0.339 . . . . 0.0 110.654 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -61.5 -28.38 69.26 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.584 -0.697 . . . . 0.0 111.84 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.3 m -69.76 -43.59 71.93 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.017 -1.052 . . . . 0.0 108.968 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.48 -42.04 81.83 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.553 0.741 . . . . 0.0 109.829 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -55.25 -56.25 22.09 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.027 -0.42 . . . . 0.0 110.113 172.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.71 -45.53 81.79 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.929 -0.482 . . . . 0.0 111.07 -178.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -53.24 -53.75 46.2 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.196 0.598 . . . . 0.0 110.105 174.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.2 mtm105 -53.62 -55.89 21.93 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.445 0.298 . . . . 0.0 110.817 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.1 mm -51.7 -51.68 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.992 0.917 . . . . 0.0 109.111 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.55 -40.5 71.98 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.392 0.277 . . . . 0.0 111.363 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.6 mt -86.57 -2.32 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.53 25.07 71.33 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 121.092 -1.005 . . . . 0.0 112.6 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -79.42 102.12 8.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -178.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 33.3 p -148.82 -67.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.447 -164.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -36.02 -43.26 0.32 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.267 2.227 . . . . 0.0 113.207 173.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 147.61 22.17 0.09 OUTLIER Glycine 0 CA--C 1.528 0.868 0 C-N-CA 123.87 0.747 . . . . 0.0 112.88 176.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -51.66 -58.24 6.93 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.487 1.143 . . . . 0.0 110.315 175.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -55.5 -45.7 78.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.343 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.97 -49.89 28.38 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 123.302 0.477 . . . . 0.0 112.762 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.26 -56.15 23.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.312 0.645 . . . . 0.0 109.925 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.07 -54.58 37.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.945 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 80.1 mmm -54.69 -44.19 73.15 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.714 1.206 . . . . 0.0 110.468 174.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -42.95 -56.09 4.59 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 125.328 1.442 . . . . 0.0 111.566 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -66.92 -49.85 64.25 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.765 0.283 . . . . 0.0 111.724 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.76 -34.56 64.77 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -134.78 -59.61 0.8 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.472 1.109 . . . . 0.0 110.93 -172.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.47 146.24 4.61 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 -171.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -81.89 69.59 8.61 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 117.646 0.723 . . . . 0.0 111.422 -169.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -106.41 -155.05 0.53 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 165.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 66.43 -82.13 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.975 0.91 . . . . 0.0 110.61 168.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m 45.05 -72.94 0.0 OUTLIER 'General case' 0 C--N 1.339 0.126 0 C-N-CA 130.011 3.324 . . . . 0.0 115.432 172.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -159.14 -50.33 0.06 Allowed 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.9 p -56.37 -72.28 0.08 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.244 1.017 . . . . 0.0 110.735 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.3 m -55.9 -37.55 69.04 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.494 0.718 . . . . 0.0 111.217 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.75 -42.68 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.618 -0.676 . . . . 0.0 111.871 172.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.4 m -65.23 -43.26 92.01 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.487 -0.758 . . . . 0.0 110.517 173.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -54.69 -47.4 73.72 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.609 0.64 . . . . 0.0 110.456 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -55.75 -59.18 5.23 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.898 1.279 . . . . 0.0 110.439 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -55.09 -38.17 67.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.1 0.96 . . . . 0.0 112.508 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.03 -8.95 58.85 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.254 1.022 . . . . 0.0 112.625 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 58.05 47.79 14.16 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.273 1.429 . . . . 0.0 110.784 -175.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.01 -47.91 15.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.052 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.14 96.57 1.09 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.9 p -68.12 81.55 0.22 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.565 0.746 . . . . 0.0 111.039 -174.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 78.4 t80 75.53 -48.56 0.61 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.97 2.108 . . . . 0.0 113.341 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -35.78 -61.52 0.47 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.504 1.922 . . . . 0.0 112.415 -169.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -79.78 -44.77 20.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.779 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 56.7 mtp -42.7 -45.52 4.75 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 125.028 1.331 . . . . 0.0 112.094 -174.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.1 t -60.64 -34.07 73.73 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -79.03 -44.47 22.15 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.082 0.944 . . . . 0.0 109.36 174.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -35.1 75.32 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.056 1.342 . . . . 0.0 113.406 -170.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -58.69 -61.62 7.33 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-O 117.769 -1.11 . . . . 0.0 112.395 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -58.74 -40.15 75.53 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.676 1.584 . . . . 0.0 110.982 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tt -51.66 -52.51 47.47 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.099 0.96 . . . . 0.0 111.387 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.1 mt -71.24 -33.89 70.27 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.558 -0.714 . . . . 0.0 111.525 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -57.68 -47.23 82.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -59.01 -47.83 83.78 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -51.11 -47.82 61.85 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.913 0.324 . . . . 0.0 110.565 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.49 94.68 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -41.08 81.06 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.878 0.471 . . . . 0.0 110.259 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -68.16 -52.66 32.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.919 0.39 . . . . 0.0 110.442 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.76 -34.81 64.87 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.328 1.051 . . . . 0.0 112.23 -171.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 N--CA 1.455 -0.218 0 C-N-CA 124.99 1.316 . . . . 0.0 110.722 -175.354 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.7 mp -51.85 -41.58 61.93 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.382 0.673 . . . . 0.0 111.064 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -52.09 -42.4 63.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.432 0.693 . . . . 0.0 111.197 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -37.92 62.64 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.846 -0.534 . . . . 0.0 109.82 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.494 HD12 ' C ' ' A' ' 9' ' ' LEU . 0.1 OUTLIER -59.55 -46.36 89.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.445 -0.788 . . . . 0.0 111.476 178.126 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -58.77 -58.49 8.36 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.77 1.168 . . . . 0.0 111.175 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -46.22 -54.41 8.83 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.707 0.803 . . . . 0.0 110.189 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -53.24 -49.96 65.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.461 1.105 . . . . 0.0 111.087 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.23 -53.77 54.35 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.521 0.6 . . . . 0.0 110.496 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -56.91 -43.04 80.98 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.314 0.578 . . . . 0.0 110.751 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.2 m -60.99 -48.01 83.82 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -54.7 -47.29 73.88 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.379 0.672 . . . . 0.0 110.052 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.44 -47.36 82.01 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.204 0.456 . . . . 0.0 111.276 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.81 -44.78 82.32 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.903 -0.498 . . . . 0.0 111.001 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.4 mmt-85 -59.59 -46.15 89.8 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.607 0.639 . . . . 0.0 110.883 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -54.7 -46.99 74.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.34 0.656 . . . . 0.0 110.596 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt -61.26 -50.15 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.348 0.659 . . . . 0.0 109.812 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -47.44 67.36 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.822 0.849 . . . . 0.0 110.329 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.1 mt -67.42 -12.97 61.55 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.751 0.82 . . . . 0.0 112.353 178.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.33 33.87 86.25 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -92.58 82.0 4.82 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.999 0.904 . . . . 0.0 108.972 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.5 t -110.1 -175.69 2.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.583 1.953 . . . . 0.0 108.808 -173.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 60.78 -71.02 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 128.017 2.527 . . . . 0.0 110.074 -175.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -171.32 38.23 0.17 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.901 1.239 . . . . 0.0 110.46 169.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.96 -51.31 70.15 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.028 1.414 . . . . 0.0 110.603 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -51.44 -46.48 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 172.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -55.47 -45.81 82.79 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 118.109 0.413 . . . . 0.0 112.517 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.99 -51.64 66.07 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 121.643 0.735 . . . . 0.0 110.41 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.1 85.51 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.752 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -42.23 80.3 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 124.097 0.959 . . . . 0.0 109.841 172.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -56.91 5.71 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 125.358 1.456 . . . . 0.0 111.154 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.65 -51.12 70.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.74 0.27 . . . . 0.0 111.615 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 mt -81.59 -25.21 35.93 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 115.135 1.531 . . . . 0.0 115.135 -168.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -143.31 -63.11 0.4 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.772 1.229 . . . . 0.0 111.133 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.27 145.28 5.18 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -81.79 56.5 3.08 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 117.839 0.82 . . . . 0.0 112.51 -167.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -88.6 -175.74 5.04 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 168.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 68.51 40.41 1.94 Allowed 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.972 -1.08 . . . . 0.0 112.634 169.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.3 p -74.96 52.5 0.55 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.965 1.306 . . . . 0.0 109.906 171.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 64.88 -44.86 0.33 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.541 1.936 . . . . 0.0 113.532 -169.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.1 p -44.12 -68.48 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.529 1.932 . . . . 0.0 111.864 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -35.54 73.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.843 0.857 . . . . 0.0 111.323 -174.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.0 mm -64.41 -46.67 92.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.257 0.623 . . . . 0.0 109.507 174.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.1 m -56.52 -45.6 81.0 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.983 -1.073 . . . . 0.0 110.22 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -57.04 -41.48 78.74 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.064 -0.397 . . . . 0.0 111.572 174.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -58.26 -52.61 64.86 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 122.973 0.509 . . . . 0.0 110.298 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.33 -27.47 69.05 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.8 -8.19 56.85 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.573 0.624 . . . . 0.0 111.87 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.31 42.14 25.38 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.987 1.715 . . . . 0.0 110.352 -171.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -79.77 -38.14 33.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.653 -173.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 mt -80.45 56.12 2.47 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.948 0.899 . . . . 0.0 112.873 -169.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.2 m 21.7 53.57 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 130.861 3.664 . . . . 0.0 116.94 169.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.1 t80 65.25 -57.32 0.3 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.321 2.249 . . . . 0.0 114.016 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -38.95 -53.09 1.77 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.447 1.899 . . . . 0.0 113.235 -175.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -72.7 -58.02 3.67 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.501 0.667 . . . . 0.0 109.217 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.3 mtp -44.1 -44.79 7.78 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.724 2.01 . . . . 0.0 112.256 -173.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.33 -31.62 72.9 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.811 0.845 . . . . 0.0 112.613 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -82.16 -37.83 25.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 171.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.071 0.948 . . . . 0.0 110.983 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -51.25 -68.32 0.4 Allowed Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.645 174.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.33 -37.63 94.22 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.862 1.708 . . . . 0.0 111.524 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -53.63 -54.06 43.01 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.678 0.672 . . . . 0.0 111.293 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 57.0 mt -67.65 -37.96 83.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 121.851 -0.531 . . . . 0.0 111.241 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -57.09 -49.97 74.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.349 0.522 . . . . 0.0 109.856 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -66.43 -42.61 87.43 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 122.246 -0.284 . . . . 0.0 110.482 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -50.59 -49.45 56.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.965 0.348 . . . . 0.0 110.173 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.24 -50.68 69.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -178.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.59 -39.71 61.89 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.637 0.775 . . . . 0.0 111.15 178.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -71.82 -52.41 17.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 117.859 0.3 . . . . 0.0 110.82 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.85 -42.33 94.98 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.151 0.98 . . . . 0.0 112.354 -170.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 . . . . . 0 CA--C 1.53 0.204 0 C-N-CA 124.459 1.103 . . . . 0.0 110.756 -176.146 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.345 0.117 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp -47.38 -40.01 16.61 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.106 0.963 . . . . 0.0 110.709 175.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -49.87 -44.78 50.04 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.328 1.451 . . . . 0.0 111.776 174.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.01 -51.58 37.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.0 mt -53.4 -48.83 68.32 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.738 -0.649 . . . . 0.0 111.787 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -59.27 -61.65 2.47 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.066 0.848 . . . . 0.0 111.247 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -50.62 -52.69 37.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.725 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.52 -50.45 65.42 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.131 0.572 . . . . 0.0 111.1 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -53.1 61.77 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.393 0.677 . . . . 0.0 110.899 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -55.11 -47.02 75.58 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.319 0.58 . . . . 0.0 109.804 177.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.8 m -62.72 -39.09 92.96 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 123.238 0.615 . . . . 0.0 110.579 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -60.02 -51.39 69.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.208 1.003 . . . . 0.0 108.885 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -56.7 -53.69 54.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.398 0.279 . . . . 0.0 110.814 175.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.45 -52.64 53.06 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.662 -0.649 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -62.55 -48.06 81.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.371 0.668 . . . . 0.0 110.761 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 -57.64 -44.15 85.4 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.67 0.668 . . . . 0.0 109.451 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 84.9 mt -59.19 -47.76 89.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 O-C-N 122.081 -0.387 . . . . 0.0 110.003 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -56.36 -40.24 74.19 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.65 0.659 . . . . 0.0 111.503 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.2 mt -72.68 -1.39 16.12 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.48 25.49 74.11 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 121.236 -0.915 . . . . 0.0 111.664 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -91.39 101.51 14.19 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.871 0.868 . . . . 0.0 108.879 -178.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.4 p -76.68 39.38 0.21 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.889 2.076 . . . . 0.0 112.729 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 71.15 -56.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.796 2.038 . . . . 0.0 111.928 176.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -53.29 -40.93 61.38 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -49.11 -55.73 11.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.531 0.732 . . . . 0.0 110.799 173.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.7 t -58.09 -56.05 18.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.68 -49.05 12.53 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-N 118.095 0.407 . . . . 0.0 112.25 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.88 -52.56 65.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.709 1.204 . . . . 0.0 110.049 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.59 -47.72 78.94 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.844 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 48.3 mmm -56.15 -46.31 79.31 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 121.695 -0.628 . . . . 0.0 109.637 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -41.49 -56.65 3.45 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 125.546 1.545 . . . . 0.0 111.662 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -65.36 -50.41 65.65 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.361 0.665 . . . . 0.0 111.801 -178.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.89 -48.18 66.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.163 0.438 . . . . 0.0 111.959 -174.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 4.3 m-85 -126.41 -56.09 1.42 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.246 1.019 . . . . 0.0 111.154 -169.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.28 152.53 6.29 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 107.934 -2.066 . . . . 0.0 107.934 -169.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -81.02 54.35 2.19 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.887 -0.773 . . . . 0.0 111.076 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.69 -15.1 61.24 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.885 -0.51 . . . . 0.0 111.501 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.78 43.8 1.74 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.104 1.762 . . . . 0.0 107.725 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.6 p -61.65 -62.8 1.55 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.838 0.855 . . . . 0.0 110.349 -169.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.475 ' NE2' ' H ' ' A' ' 45' ' ' THR . 0.2 OUTLIER -161.48 -55.31 0.05 OUTLIER 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.199 0.599 . . . . 0.0 112.226 178.688 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.475 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -57.96 -52.93 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.407 1.083 . . . . 0.0 109.423 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 p -55.03 -51.53 66.0 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.184 0.994 . . . . 0.0 111.67 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -59.39 -46.98 92.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 O-C-N 122.02 -0.425 . . . . 0.0 110.71 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.0 m -56.43 -50.5 71.47 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.938 0.875 . . . . 0.0 110.77 175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -62.03 -30.1 70.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.765 1.226 . . . . 0.0 111.454 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -61.23 -57.4 12.56 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.176 0.591 . . . . 0.0 109.796 173.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.07 -30.52 68.13 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.61 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.34 -7.45 59.07 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp 50.05 36.95 13.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.14 1.776 . . . . 0.0 112.106 -171.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -80.19 -31.57 38.74 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.844 -0.535 . . . . 0.0 111.861 -175.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -79.11 53.53 1.46 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.718 0.807 . . . . 0.0 111.554 -175.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.7 m -5.23 71.57 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 130.407 3.483 . . . . 0.0 116.49 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.7 t80 66.64 -57.81 0.39 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.938 2.095 . . . . 0.0 114.262 174.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.8 -55.56 3.6 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.517 1.527 . . . . 0.0 113.734 -169.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.18 -46.92 39.05 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 57.4 mtp -50.82 -42.11 58.03 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.342 1.457 . . . . 0.0 111.273 -173.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 53.4 t -64.36 -28.42 69.69 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.782 0.833 . . . . 0.0 112.663 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -82.7 -45.06 14.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.863 0.839 . . . . 0.0 109.425 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . 0.267 0.1 OUTLIER -59.84 -46.92 87.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.819 1.247 . . . . 0.0 112.609 -178.249 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -55.12 -58.3 15.55 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -59.73 -34.81 95.96 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.848 1.698 . . . . 0.0 111.488 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.9 mp -63.69 -45.35 90.45 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 19.1 mt -62.9 -39.63 95.11 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 173.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.64 -50.37 74.1 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.899 0.772 . . . . 0.0 109.361 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.65 -47.8 81.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.358 0.663 . . . . 0.0 110.27 175.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -53.02 -43.45 66.56 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 122.228 -0.295 . . . . 0.0 110.487 174.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.88 -46.78 80.32 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -39.64 73.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.028 0.531 . . . . 0.0 110.611 176.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.52 -58.1 4.06 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.94 0.496 . . . . 0.0 111.537 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.77 -37.75 62.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.601 1.16 . . . . 0.0 112.158 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 . . . . . 0 C--O 1.233 0.219 0 C-N-CA 125.038 1.335 . . . . 0.0 111.748 -178.247 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.773 0.32 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mp -50.91 -43.6 59.89 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.422 0.689 . . . . 0.0 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.4 mp0 -49.84 -45.43 50.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.198 1.399 . . . . 0.0 111.05 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.21 -48.36 57.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -55.79 -54.04 49.26 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.414 0.686 . . . . 0.0 111.444 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.04 -56.59 20.24 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-N 119.027 0.831 . . . . 0.0 111.137 -177.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.38 -54.88 18.5 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.386 0.674 . . . . 0.0 110.475 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -54.21 -48.96 70.45 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 122.904 0.482 . . . . 0.0 110.744 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -52.37 65.81 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.142 0.977 . . . . 0.0 111.066 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -59.42 -46.97 87.21 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.627 -0.67 . . . . 0.0 110.122 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.8 m -60.71 -38.42 84.99 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 122.022 -0.423 . . . . 0.0 110.129 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.39 -46.28 90.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.847 0.859 . . . . 0.0 109.171 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -56.21 -50.67 70.6 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.266 0.484 . . . . 0.0 110.444 174.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -56.86 -48.5 77.97 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.162 -0.961 . . . . 0.0 110.885 178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -57.55 -42.37 82.84 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.934 -0.479 . . . . 0.0 111.061 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -54.64 -49.08 71.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.489 1.115 . . . . 0.0 110.349 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.2 mm -61.71 -48.82 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.233 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -57.95 -44.43 87.0 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.259 0.481 . . . . 0.0 111.389 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.2 mt -64.43 -37.98 89.44 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.255 0.622 . . . . 0.0 110.35 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 95.55 34.36 6.08 Favored Glycine 0 CA--C 1.525 0.719 0 C-N-CA 124.369 0.985 . . . . 0.0 111.348 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -79.42 74.97 6.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 122.938 1.351 . . . . 0.0 108.258 173.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.1 t -57.05 145.04 32.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.467 3.507 . . . . 0.0 111.765 -168.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 56.01 -77.71 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.029 1.732 . . . . 0.0 109.725 -172.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -160.9 46.56 0.39 Allowed Glycine 0 CA--C 1.523 0.558 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 169.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -61.53 -14.72 31.89 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.237 1.019 . . . . 0.0 111.952 -175.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 88.0 t -42.42 -43.46 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 124.28 1.032 . . . . 0.0 109.259 167.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.42 -45.63 16.68 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.125 0.869 . . . . 0.0 113.566 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.6 tp -70.07 -52.79 21.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.725 0.774 . . . . 0.0 109.87 -176.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.97 80.99 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.386 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.7 mmm -53.92 -47.3 71.33 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 110.318 170.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -40.48 -54.2 3.38 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 125.308 1.432 . . . . 0.0 111.461 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.62 -53.14 37.41 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 mt -76.15 -31.94 58.83 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -168.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -135.63 -56.69 0.79 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.461 1.105 . . . . 0.0 110.52 -176.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 163.83 156.17 8.63 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -170.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.66 74.12 5.2 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.839 0.82 . . . . 0.0 110.489 -169.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -109.38 159.91 16.61 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 73.74 33.88 0.98 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.509 1.123 . . . . 0.0 113.771 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.4 m -75.05 65.29 1.45 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 64.05 -59.15 0.2 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.163 2.185 . . . . 0.0 112.5 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.1 p -32.19 -66.28 0.13 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.002 1.721 . . . . 0.0 113.081 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.17 -30.93 71.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.922 0.889 . . . . 0.0 112.383 -177.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 26.0 mm -67.15 -49.06 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.2 m -52.45 -53.61 43.18 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.579 -0.701 . . . . 0.0 110.373 173.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -59.36 -37.81 78.82 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.616 0.766 . . . . 0.0 111.364 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 63' ' ' LEU . 7.8 t80 -61.37 -60.3 3.93 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.268 0.627 . . . . 0.0 110.039 177.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.26 -41.59 76.05 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.12 -11.98 58.7 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 55.39 46.59 23.01 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.303 1.441 . . . . 0.0 110.911 -173.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -79.92 -41.12 26.73 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.439 1.095 . . . . 0.0 110.929 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.3 mt -77.91 -162.23 0.31 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.3 m -154.73 173.29 16.62 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 120.772 -1.205 . . . . 0.0 109.104 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -41.53 0.86 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 128.07 2.548 . . . . 0.0 112.07 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -39.61 -39.48 0.75 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.131 1.372 . . . . 0.0 112.023 176.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -104.75 -56.02 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.685 1.594 . . . . 0.0 109.743 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.0 mtt -47.15 -39.52 13.8 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.128 1.771 . . . . 0.0 113.945 -170.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.0 t -66.42 -25.31 66.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -90.03 -40.28 12.41 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.0 OUTLIER -55.93 -43.23 77.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.332 0.653 . . . . 0.0 111.814 -178.438 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -54.02 -65.77 1.12 Allowed Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 118.978 -0.534 . . . . 0.0 112.216 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -58.78 -40.75 69.69 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.891 1.728 . . . . 0.0 111.655 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 tt -49.19 -51.99 29.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 111.172 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.55 -40.21 80.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 121.775 -0.578 . . . . 0.0 111.275 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -61.68 -44.7 96.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.453 1.024 . . . . 0.0 110.259 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -61.65 -46.67 88.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.716 -0.615 . . . . 0.0 109.812 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -50.79 -46.58 59.7 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.791 0.269 . . . . 0.0 110.32 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.75 -48.85 79.93 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.761 0.824 . . . . 0.0 109.239 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.25 -48.82 77.88 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -57.6 -48.57 79.03 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.15 0.58 . . . . 0.0 109.64 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.5 33.38 0.7 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.61 1.164 . . . . 0.0 110.993 176.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 124.169 0.988 . . . . 0.0 110.937 -176.71 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.2 t0 . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.0 mp -41.6 -48.77 4.09 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 125.006 1.322 . . . . 0.0 111.484 -177.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -45.67 -47.53 15.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.241 1.416 . . . . 0.0 112.003 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -74.32 -49.66 21.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.73 -48.99 71.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.366 0.667 . . . . 0.0 111.496 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -61.19 -61.13 2.78 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.615 0.643 . . . . 0.0 110.843 -178.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -51.38 -48.28 62.61 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.413 0.685 . . . . 0.0 110.509 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -54.72 -51.83 64.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.763 0.425 . . . . 0.0 110.48 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.38 -52.83 58.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.35 0.523 . . . . 0.0 111.274 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -54.5 -46.45 73.47 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.896 0.379 . . . . 0.0 110.017 177.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.0 m -59.75 -42.54 93.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.821 0.449 . . . . 0.0 110.383 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -60.64 -44.87 95.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 122.844 0.458 . . . . 0.0 109.917 177.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -59.3 -48.92 79.81 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.724 -0.61 . . . . 0.0 111.079 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -55.45 -50.26 70.31 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.249 0.62 . . . . 0.0 110.141 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -52.01 -55.63 19.31 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.333 1.053 . . . . 0.0 110.373 173.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -53.19 -49.27 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 110.439 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.1 mt -60.39 -44.94 97.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.539 0.736 . . . . 0.0 110.128 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -57.92 -41.37 82.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.749 0.704 . . . . 0.0 111.075 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.09 -10.81 59.95 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 173.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.15 73.88 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -94.62 154.96 17.1 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.623 0.769 . . . . 0.0 109.901 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -178.59 -174.83 0.4 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 -172.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 16.38 -84.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 129.12 2.968 . . . . 0.0 114.186 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 -33.36 40.62 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.927 -0.93 . . . . 0.0 113.479 -170.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -67.43 -70.86 0.23 Allowed 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.462 1.631 . . . . 0.0 112.809 -167.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.2 t -55.66 -41.02 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.9 -52.77 24.81 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.097 0.856 . . . . 0.0 112.993 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 tp -72.32 -47.52 49.1 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 117.997 0.898 . . . . 0.0 110.639 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.63 -51.71 64.55 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.288 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 62.4 mtp -64.56 -37.6 88.11 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 121.895 -0.503 . . . . 0.0 110.699 170.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -37.83 -56.75 1.68 Allowed Glycine 0 C--O 1.229 -0.206 0 C-N-CA 126.083 1.801 . . . . 0.0 111.262 172.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 pttp -76.1 -45.94 31.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.6 tp -72.02 -16.49 62.06 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -170.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -153.81 -64.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.856 1.662 . . . . 0.0 111.097 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 168.94 149.08 6.03 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 -169.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.93 67.77 8.05 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 117.746 0.773 . . . . 0.0 111.137 -168.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -121.76 170.73 9.46 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.501 1.52 . . . . 0.0 107.53 171.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.428 ' HB3' HG12 ' A' ' 47' ' ' ILE . 79.3 m-85 62.26 45.06 7.07 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.305 1.042 . . . . 0.0 111.44 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -62.53 -59.09 5.44 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.2 1.0 . . . . 0.0 109.072 169.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.59 -51.38 0.06 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.64 1.576 . . . . 0.0 108.849 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.9 p -50.63 -58.67 5.3 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.353 1.061 . . . . 0.0 111.742 -175.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.38 78.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.7 1.2 . . . . 0.0 111.1 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.428 HG12 ' HB3' ' A' ' 42' ' ' PHE . 7.8 mm -63.82 -56.54 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.799 0.84 . . . . 0.0 109.239 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.9 m -50.33 -45.38 54.82 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.215 -0.928 . . . . 0.0 111.275 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -60.8 -37.48 82.09 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.416 ' CD2' HD11 ' A' ' 63' ' ' LEU . 6.2 t80 -59.0 -55.49 34.46 Favored 'General case' 0 CA--C 1.522 -0.114 0 CA-C-N 118.71 0.687 . . . . 0.0 109.699 172.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.04 -31.46 70.0 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.8 -2.57 40.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.177 0.591 . . . . 0.0 112.421 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mp 53.52 35.75 21.59 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.88 1.672 . . . . 0.0 112.252 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.97 -31.53 50.83 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.99 39.68 0.51 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.961 0.904 . . . . 0.0 109.937 176.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.8 m -37.83 94.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 128.864 2.866 . . . . 0.0 115.567 -167.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.9 t80 69.2 -56.89 0.54 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 128.197 2.599 . . . . 0.0 113.63 173.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -39.72 -51.6 2.33 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.535 1.934 . . . . 0.0 112.83 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -47.53 14.98 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.7 mtt -44.24 -40.09 4.91 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.458 1.903 . . . . 0.0 112.847 -169.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 24.2 t -65.07 -25.97 68.04 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 118.473 -1.291 . . . . 0.0 112.912 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -90.17 -45.16 9.28 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 169.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -56.95 -42.28 79.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 125.143 1.377 . . . . 0.0 112.476 -174.256 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.6 -62.0 6.83 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.362 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.96 -38.35 92.5 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.342 1.361 . . . . 0.0 111.735 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.31 -55.49 27.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.642 0.777 . . . . 0.0 111.449 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.38 -37.45 83.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 121.074 -1.016 . . . . 0.0 111.254 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -58.5 -47.85 82.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.594 -0.691 . . . . 0.0 109.276 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -61.55 -44.05 97.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.359 0.663 . . . . 0.0 110.085 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 79.7 t90 -52.49 -49.29 65.02 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.769 0.713 . . . . 0.0 110.563 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.25 -48.55 77.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.549 0.74 . . . . 0.0 109.427 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -56.55 -45.13 81.4 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 122.687 0.395 . . . . 0.0 110.654 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.67 -47.55 85.74 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.978 0.511 . . . . 0.0 110.86 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.54 -45.38 91.95 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.466 0.706 . . . . 0.0 110.998 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 . . . . . 0 CA--C 1.531 0.248 0 C-N-CA 124.278 1.031 . . . . 0.0 111.27 176.436 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.342 0.115 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.64 -40.4 62.74 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.165 0.586 . . . . 0.0 111.373 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -50.3 -37.17 35.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.572 1.149 . . . . 0.0 111.875 173.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -83.86 -45.01 13.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.986 0.514 . . . . 0.0 110.381 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.15 -46.87 62.16 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.657 177.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -57.76 -63.53 1.21 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.133 0.879 . . . . 0.0 111.511 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -55.7 -46.01 77.76 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.551 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.06 -52.41 64.37 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.98 0.512 . . . . 0.0 110.093 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.27 74.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.886 -0.509 . . . . 0.0 109.946 -177.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -56.19 -33.98 65.8 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.969 -0.457 . . . . 0.0 111.569 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.3 m -69.52 -40.43 76.93 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 121.469 -0.769 . . . . 0.0 109.449 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -58.27 -41.57 84.58 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -57.81 -51.6 68.93 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.97 -0.456 . . . . 0.0 110.814 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -55.57 -48.16 75.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.102 0.561 . . . . 0.0 110.417 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.67 -46.77 86.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.335 0.654 . . . . 0.0 110.771 176.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 mtm105 -55.15 -50.22 69.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.813 -0.554 . . . . 0.0 110.99 174.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.9 mt -54.71 -51.25 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -54.51 -45.36 73.28 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 122.678 0.391 . . . . 0.0 111.358 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 mt -74.16 -17.74 60.87 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.658 0.783 . . . . 0.0 112.368 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.02 32.19 72.99 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.051 0.834 . . . . 0.0 111.07 -170.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -95.01 124.34 39.0 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.811 0.844 . . . . 0.0 111.088 -173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -166.77 -168.83 1.2 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 -172.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 55.68 -73.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.553 2.341 . . . . 0.0 111.48 -173.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -167.46 34.88 0.21 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 124.141 0.877 . . . . 0.0 111.304 170.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.12 -53.13 59.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.486 1.143 . . . . 0.0 108.77 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.3 -48.46 32.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.939 170.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.19 -49.99 17.63 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.275 0.94 . . . . 0.0 112.095 176.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 tp -62.39 -53.35 56.27 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.802 0.841 . . . . 0.0 110.702 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.94 78.12 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.366 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtp -55.39 -43.01 74.8 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 123.768 0.827 . . . . 0.0 110.233 169.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -44.24 -53.76 6.57 Favored Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.456 1.503 . . . . 0.0 111.73 168.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -62.65 -48.8 77.74 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.409 0.283 . . . . 0.0 111.373 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.65 -48.36 22.44 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 3.8 m-85 -125.12 -62.47 1.22 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.358 1.863 . . . . 0.0 112.952 -168.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 174.52 138.49 2.73 Favored Glycine 0 CA--C 1.531 1.089 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.52 59.15 4.5 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.506 0.722 . . . . 0.0 111.593 -167.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.57 -20.0 19.34 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -172.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -101.78 78.6 1.83 Allowed 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -166.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.5 t -73.47 171.14 13.7 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 165.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.28 -38.61 42.0 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 m -54.17 -57.76 9.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.569 1.147 . . . . 0.0 111.854 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -41.49 92.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.62 0.768 . . . . 0.0 110.109 -176.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -59.27 -43.2 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 122.015 -0.428 . . . . 0.0 110.966 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.2 m -59.12 -43.24 91.93 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 118.692 0.678 . . . . 0.0 110.093 174.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -47.87 61.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.611 0.364 . . . . 0.0 110.815 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.564 ' CD1' HD13 ' A' ' 63' ' ' LEU . 27.5 t80 -62.93 -54.93 30.89 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 122.37 0.268 . . . . 0.0 111.624 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.51 -23.24 66.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.096 0.958 . . . . 0.0 113.11 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.26 -7.62 59.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.844 0.858 . . . . 0.0 111.186 169.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp 52.24 44.34 29.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 126.387 1.875 . . . . 0.0 110.019 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -79.52 -33.58 41.9 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.024 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.5 mt -78.35 46.09 0.6 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.878 0.871 . . . . 0.0 112.621 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.3 t 60.77 -76.59 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.067 2.147 . . . . 0.0 113.179 174.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.1 t80 176.28 -47.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 126.554 1.942 . . . . 0.0 107.795 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -54.03 2.73 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.562 1.545 . . . . 0.0 112.995 -176.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -76.24 -56.45 4.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 37.9 mtp -38.33 -49.04 1.39 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.438 2.295 . . . . 0.0 112.178 -178.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.13 -41.7 84.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.0 0.92 . . . . 0.0 112.589 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -77.68 -34.72 52.81 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.3 0.64 . . . . 0.0 109.902 175.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.564 HD13 ' CD1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -53.77 -50.89 65.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.084 1.353 . . . . 0.0 110.511 177.611 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -46.2 -64.14 1.06 Allowed Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.26 -34.82 98.12 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 121.973 1.782 . . . . 0.0 111.837 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.413 ' HG ' ' CE2' ' A' ' 38' ' ' TYR . 1.5 mp -61.61 -51.99 66.24 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.57 -39.24 90.46 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.652 0.381 . . . . 0.0 111.283 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.15 -51.86 67.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.941 -0.474 . . . . 0.0 110.182 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.14 -43.5 98.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.7 0.4 . . . . 0.0 110.157 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -52.59 -45.29 66.44 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 172.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.11 -46.56 80.53 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.66 -40.92 66.31 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.985 0.514 . . . . 0.0 110.59 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -70.03 -55.3 9.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.769 0.428 . . . . 0.0 111.543 177.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.36 -46.05 51.44 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.17 0.988 . . . . 0.0 112.766 -169.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 . . . . . 0 CA--C 1.53 0.173 0 C-N-CA 125.68 1.592 . . . . 0.0 112.963 -172.139 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -44.01 -45.37 7.86 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 125.305 1.442 . . . . 0.0 112.356 -170.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -37.24 -51.75 1.04 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.116 1.366 . . . . 0.0 111.455 174.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.22 -48.73 78.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.795 0.838 . . . . 0.0 110.05 -178.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.42 -48.32 82.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.431 1.092 . . . . 0.0 110.155 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.09 -58.16 9.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.716 0.769 . . . . 0.0 109.896 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -56.32 -51.51 67.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.511 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -51.53 -52.86 43.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 110.822 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -53.48 44.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.032 0.833 . . . . 0.0 110.708 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -67.25 -12.54 60.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 58.2 m -90.29 -38.19 13.56 Favored 'General case' 0 C--O 1.228 -0.076 0 C-N-CA 124.129 0.972 . . . . 0.0 109.537 175.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -53.05 -44.83 67.72 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.848 0.859 . . . . 0.0 108.885 173.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -48.58 -56.86 7.25 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.245 0.618 . . . . 0.0 111.602 169.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -60.4 -49.38 77.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 O-C-N 121.991 -0.443 . . . . 0.0 110.483 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -55.95 -52.09 65.39 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.895 0.316 . . . . 0.0 110.188 176.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -50.99 -50.56 58.19 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.252 1.021 . . . . 0.0 110.786 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -59.98 -51.43 72.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 123.085 0.554 . . . . 0.0 110.253 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.23 -40.71 82.44 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.591 0.632 . . . . 0.0 111.532 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.5 mt -67.8 -16.3 64.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.696 0.799 . . . . 0.0 111.449 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.57 29.77 74.3 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -173.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -90.63 108.29 19.71 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.932 0.872 . . . . 0.0 109.147 -174.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 65.4 p -67.92 168.6 11.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.019 1.327 . . . . 0.0 109.859 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.67 -40.16 65.7 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 169.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.01 -55.32 29.82 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 173.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -56.03 -56.42 20.97 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 117.429 0.614 . . . . 0.0 110.735 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.6 t -59.17 -46.55 92.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -49.64 -52.6 24.23 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.9 tp -60.08 -54.47 45.6 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 123.518 0.727 . . . . 0.0 110.808 -178.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.34 -45.85 91.98 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.127 -176.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.416 ' SD ' ' CD1' ' A' ' 70' ' ' TRP . 73.9 mmm -56.83 -45.15 82.51 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.803 -0.561 . . . . 0.0 110.084 171.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.54 -55.72 5.17 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 124.916 1.246 . . . . 0.0 111.224 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 tptp -52.93 -48.85 67.01 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.652 0.781 . . . . 0.0 112.293 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 41.6 mt -90.01 -35.91 15.24 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -169.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -132.57 -59.26 0.91 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.259 1.423 . . . . 0.0 110.889 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.98 142.69 3.46 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 107.85 -2.1 . . . . 0.0 107.85 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -79.41 38.36 0.36 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.309 1.054 . . . . 0.0 113.314 -168.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.56 39.11 0.59 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.463 -0.773 . . . . 0.0 111.134 -174.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -144.19 31.14 1.25 Allowed 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 125.51 1.524 . . . . 0.0 108.996 -169.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.7 m -76.66 67.25 2.74 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.488 1.115 . . . . 0.0 108.163 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 75.15 -48.0 0.62 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.524 1.929 . . . . 0.0 113.124 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.5 p -49.23 -79.41 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.075 1.35 . . . . 0.0 112.266 -172.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.2 p -54.31 -44.97 72.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.404 1.082 . . . . 0.0 110.525 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.34 -53.62 37.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.716 0.806 . . . . 0.0 111.202 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.8 p -60.35 -48.88 79.85 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.775 -0.578 . . . . 0.0 110.15 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -58.27 -34.95 71.06 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.759 0.423 . . . . 0.0 111.984 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -69.43 -53.05 21.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 123.629 0.772 . . . . 0.0 110.307 178.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -55.6 -40.25 71.82 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.832 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.88 -10.79 59.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.359 1.064 . . . . 0.0 112.838 173.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.4 mt 58.74 45.66 15.36 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 127.121 2.168 . . . . 0.0 112.767 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.32 -30.45 30.45 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.844 1.258 . . . . 0.0 111.119 176.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -80.26 47.92 0.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.981 0.912 . . . . 0.0 113.094 -168.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 m -16.99 84.31 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 129.545 3.138 . . . . 0.0 116.82 -171.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.2 t80 66.05 -58.08 0.34 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 127.714 2.406 . . . . 0.0 114.725 172.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -44.25 -50.54 8.84 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.612 1.565 . . . . 0.0 112.379 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -47.07 21.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.0 mtt -45.6 -46.15 14.17 Favored 'General case' 0 C--O 1.225 -0.237 0 C-N-CA 125.22 1.408 . . . . 0.0 111.636 -174.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.9 t -64.82 -22.78 67.06 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -174.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -90.04 -46.87 8.21 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.369 1.08 . . . . 0.0 108.696 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.23 -38.74 77.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.971 1.708 . . . . 0.0 111.734 -175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -61.39 -63.04 4.77 Favored Pre-proline 0 N--CA 1.452 -0.327 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.16 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -58.1 -39.94 81.27 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 CA-C-N 120.869 1.346 . . . . 0.0 111.181 176.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.62 -57.23 11.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.18 0.592 . . . . 0.0 111.433 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.2 mt -69.43 -34.11 73.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -58.38 -49.53 76.91 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.018 0.827 . . . . 0.0 109.08 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -62.29 -43.75 98.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.416 ' CD1' ' SD ' ' A' ' 34' ' ' MET . 67.0 t90 -53.16 -49.53 66.42 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 117.906 0.321 . . . . 0.0 110.978 172.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -50.62 72.5 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -174.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -54.31 -53.01 59.62 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.37 0.668 . . . . 0.0 110.84 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -56.42 -51.87 66.76 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.378 0.671 . . . . 0.0 110.969 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.4 -49.39 76.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.312 0.645 . . . . 0.0 110.207 178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 173.83 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.7 t0 . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp -43.25 -40.81 3.61 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.403 1.881 . . . . 0.0 112.912 -169.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -40.15 -42.37 1.45 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.991 1.716 . . . . 0.0 112.467 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -74.59 -48.93 23.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.588 0.755 . . . . 0.0 110.244 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.11 -45.67 90.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.747 0.819 . . . . 0.0 111.088 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -57.43 -60.33 3.81 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 119.381 0.992 . . . . 0.0 111.04 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -56.91 -46.42 81.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.224 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -54.44 -48.6 71.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.329 0.513 . . . . 0.0 111.042 176.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.8 -51.41 67.19 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.614 1.166 . . . . 0.0 110.465 -176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -57.15 -45.28 83.73 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.502 0.668 . . . . 0.0 109.563 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.1 m -64.26 -32.18 73.67 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.909 -0.494 . . . . 0.0 110.494 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -63.28 -48.07 79.67 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.764 1.166 . . . . 0.0 109.345 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -52.3 -53.01 49.69 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 171.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -59.37 -44.35 92.73 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.649 -0.657 . . . . 0.0 111.81 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -59.12 -48.46 81.52 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.498 0.719 . . . . 0.0 110.312 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 64.9 ttp85 -52.04 -49.38 63.56 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.654 0.782 . . . . 0.0 110.252 175.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.03 -47.4 91.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 122.702 0.401 . . . . 0.0 110.143 178.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -59.26 -41.14 88.09 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.835 0.743 . . . . 0.0 111.604 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.53 -17.66 64.11 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.027 -0.42 . . . . 0.0 111.695 172.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.43 28.46 71.18 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -173.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -88.8 120.09 29.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.47 0.635 . . . . 0.0 109.793 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.39 147.29 51.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 167.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -54.19 -27.97 37.6 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.138 0.575 . . . . 0.0 110.524 170.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.32 -45.62 95.81 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 171.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -64.63 -46.82 80.96 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.4 t -52.93 -52.84 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.07 175.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.37 -49.38 45.15 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.266 0.46 . . . . 0.0 112.262 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.4 tp -62.4 -53.64 51.92 Favored 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 121.701 0.762 . . . . 0.0 110.872 -177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.97 92.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.745 0.818 . . . . 0.0 110.387 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -44.99 79.52 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.012 0.525 . . . . 0.0 109.747 171.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.08 -58.03 3.93 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 125.62 1.581 . . . . 0.0 111.352 169.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.8 -52.75 62.92 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.8 mt -75.34 -34.48 61.2 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -134.96 -59.5 0.79 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.087 0.955 . . . . 0.0 111.067 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 170.63 154.72 9.76 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 -171.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.12 68.24 4.11 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 123.604 0.761 . . . . 0.0 110.57 -169.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -112.29 172.69 6.76 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.59 1.956 . . . . 0.0 107.416 173.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 70.73 19.58 5.92 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.8 p -72.92 79.51 1.17 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 169.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 64.46 -67.16 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.412 2.285 . . . . 0.0 112.408 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 p -29.09 -75.45 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 127.829 2.452 . . . . 0.0 113.043 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -46.35 74.45 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.769 1.227 . . . . 0.0 111.251 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.6 mm -58.81 -49.92 81.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.484 1.114 . . . . 0.0 109.584 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.9 m -56.35 -54.1 49.47 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.83 -0.544 . . . . 0.0 110.226 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -71.05 -22.0 62.18 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -176.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 63' ' ' LEU . 12.5 t80 -64.86 -56.26 14.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 169.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.07 -38.32 65.16 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 119.336 -0.364 . . . . 0.0 111.608 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.2 3.22 24.5 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mp 48.13 53.63 11.41 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.769 2.027 . . . . 0.0 114.779 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.55 -55.23 5.0 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.781 0.8 . . . . 0.0 111.326 170.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.98 -27.31 61.33 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -167.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m 67.94 164.88 0.23 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.597 1.159 . . . . 0.0 113.354 175.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -44.51 -45.48 9.29 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.178 1.391 . . . . 0.0 112.367 -169.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -36.05 -48.89 0.62 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 126.487 1.915 . . . . 0.0 113.14 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.58 -47.84 6.35 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 44.8 mtt -50.31 -41.43 51.07 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.922 -171.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.59 -21.33 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -176.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -89.22 -45.13 9.78 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.448 HD11 ' CE2' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -61.62 -39.74 92.36 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.36 0.664 . . . . 0.0 112.464 -174.012 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -57.89 -61.68 6.92 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.964 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.35 -39.86 73.2 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.455 1.437 . . . . 0.0 111.341 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 tt -51.5 -52.48 46.42 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.438 0.563 . . . . 0.0 111.155 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.3 -38.74 88.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.67 -0.644 . . . . 0.0 111.398 177.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.1 -48.09 79.46 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.299 0.499 . . . . 0.0 109.703 178.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -69.95 -36.25 75.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.217 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -52.82 -49.12 66.32 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 119.033 0.833 . . . . 0.0 109.644 169.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -52.42 65.73 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.14 -46.61 62.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.641 0.776 . . . . 0.0 110.733 178.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -64.57 -54.27 34.77 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.007 0.523 . . . . 0.0 110.466 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.77 66.95 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.659 0.783 . . . . 0.0 110.488 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 169.745 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.618 0.247 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.1 mp -43.98 -45.37 7.77 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.602 1.161 . . . . 0.0 111.565 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -51.39 -46.47 62.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.047 0.939 . . . . 0.0 111.405 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.8 -53.66 25.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 86.0 mt -54.59 -49.67 69.84 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.948 0.899 . . . . 0.0 111.876 -172.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.61 -60.95 2.98 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.07 0.85 . . . . 0.0 110.837 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.44 -55.87 11.65 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.659 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -49.42 -51.86 32.52 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.133 0.573 . . . . 0.0 110.748 177.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.26 -50.1 73.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.737 -0.602 . . . . 0.0 111.425 -174.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -60.2 -29.62 68.83 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.682 -0.636 . . . . 0.0 110.625 175.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.6 m -73.45 -42.57 61.78 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.476 -0.765 . . . . 0.0 109.44 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -52.26 -52.18 54.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -53.29 -54.93 29.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -55.72 -55.22 34.88 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.865 -0.522 . . . . 0.0 111.178 -178.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -60.49 -46.33 90.51 Favored 'General case' 0 C--O 1.224 -0.244 0 O-C-N 121.988 -0.445 . . . . 0.0 110.99 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -47.99 -51.93 21.86 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.675 1.19 . . . . 0.0 110.858 174.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.8 mt -60.36 -51.6 71.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 122.832 0.453 . . . . 0.0 109.876 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -56.34 -40.43 74.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.792 0.724 . . . . 0.0 112.105 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.47 -15.13 62.78 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.149 0.98 . . . . 0.0 111.565 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.78 19.83 79.74 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 123.754 0.692 . . . . 0.0 111.871 -177.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -85.88 94.55 9.2 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.2 t -61.04 155.75 19.5 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.232 0.539 . . . . 0.0 110.406 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.43 75.55 1.04 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 168.82 -50.72 0.22 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 106.802 -2.519 . . . . 0.0 106.802 -169.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.25 -45.91 91.18 Favored 'General case' 0 C--N 1.341 0.233 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -52.7 -55.15 12.61 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 171.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.41 -49.63 14.95 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.654 0.661 . . . . 0.0 112.04 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.16 -54.37 46.65 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.118 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.24 82.69 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.705 0.802 . . . . 0.0 111.454 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 90.2 mmm -51.21 -46.13 62.12 Favored 'General case' 0 C--N 1.333 -0.112 0 C-N-CA 125.241 1.416 . . . . 0.0 109.54 169.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -45.0 -58.1 5.12 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 125.317 1.436 . . . . 0.0 111.882 168.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.45 -50.03 75.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.526 0.33 . . . . 0.0 111.307 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.3 mt -65.54 -49.41 69.01 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.273 0.488 . . . . 0.0 111.75 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -132.43 -55.42 0.96 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.193 0.997 . . . . 0.0 111.318 -169.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 156.98 142.26 3.37 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 108.531 -1.827 . . . . 0.0 108.531 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -81.14 74.8 8.13 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.142 0.971 . . . . 0.0 109.397 -174.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -98.02 26.09 5.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.148 167.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -141.99 42.71 1.69 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.27 -0.893 . . . . 0.0 110.073 -168.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.5 m -79.33 173.58 12.44 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -46.88 -44.45 19.63 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.646 0.778 . . . . 0.0 111.834 -171.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.0 p -48.84 -66.58 0.38 Allowed 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.206 1.402 . . . . 0.0 112.015 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -69.24 -40.7 77.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.714 0.806 . . . . 0.0 111.513 -173.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -61.39 -44.33 98.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.755 -0.591 . . . . 0.0 110.238 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 56.4 m -58.67 -45.06 90.23 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.014 -0.428 . . . . 0.0 110.621 170.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -40.24 66.67 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.541 0.736 . . . . 0.0 111.316 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 67' ' ' LEU . 47.7 t80 -66.41 -60.36 2.83 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.311 1.045 . . . . 0.0 110.911 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -62.29 -26.37 68.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.02 8.13 34.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.858 0.863 . . . . 0.0 111.807 172.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp 43.64 36.38 1.23 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 126.752 2.021 . . . . 0.0 113.089 -178.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 -32.59 59.37 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.8 mt -57.76 -14.66 6.16 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.527 0.731 . . . . 0.0 112.183 168.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.2 m 72.58 -65.97 0.33 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.893 1.677 . . . . 0.0 113.728 168.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -169.26 -52.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.465 0.706 . . . . 0.0 110.443 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -37.62 -57.21 0.98 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.256 1.823 . . . . 0.0 113.295 -173.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -81.97 -43.64 17.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.676 0.751 . . . . 0.0 110.159 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 58.7 mtp -43.53 -42.51 5.01 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 125.023 1.329 . . . . 0.0 112.388 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.1 t -63.06 -21.55 66.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -90.7 -47.2 7.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.098 0.959 . . . . 0.0 109.487 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.64 -52.47 6.36 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.202 1.801 . . . . 0.0 110.371 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -61.47 -57.95 21.83 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 117.493 -1.241 . . . . 0.0 112.096 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -44.27 -49.27 8.96 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.43 2.087 . . . . 0.0 112.295 170.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 mp -60.53 -50.44 73.53 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 -172.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.413 HD12 ' CE2' ' A' ' 50' ' ' PHE . 7.4 mt -64.64 -35.62 81.61 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.07 0.548 . . . . 0.0 111.985 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -62.26 -48.65 78.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -58.25 -46.89 85.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.405 173.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -52.07 -50.21 61.99 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.432 0.56 . . . . 0.0 111.047 175.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -42.26 89.8 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.844 0.458 . . . . 0.0 109.825 -173.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -53.46 -58.98 5.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.125 0.488 . . . . 0.0 109.879 170.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -58.91 -47.5 84.77 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.264 0.626 . . . . 0.0 110.404 -171.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.6 31.22 1.06 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.794 1.238 . . . . 0.0 111.543 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 . . . . . 0 CA--C 1.531 0.214 0 C-N-CA 123.665 0.786 . . . . 0.0 111.02 -178.033 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.532 0.273 0 CA-C-O 120.289 0.09 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.0 mp -42.76 -54.15 4.22 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.398 1.479 . . . . 0.0 111.609 -170.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -51.08 -46.99 61.95 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.597 1.159 . . . . 0.0 111.169 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.2 mp0 -69.33 -43.98 72.6 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.32 -51.47 45.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.79 1.636 . . . . 0.0 112.098 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -56.49 21.35 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.978 0.894 . . . . 0.0 109.637 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -52.31 -53.96 37.64 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.396 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -51.15 -53.11 37.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.65 1.18 . . . . 0.0 111.003 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.4 -48.09 81.79 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.908 0.483 . . . . 0.0 110.463 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.34 -37.29 86.69 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.145 0.498 . . . . 0.0 111.521 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.4 m -65.71 -36.68 84.32 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 121.81 -0.557 . . . . 0.0 109.884 176.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -56.73 -45.1 82.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.393 0.542 . . . . 0.0 111.142 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -59.47 -49.14 78.94 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.036 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -59.28 -46.94 87.18 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.881 -0.512 . . . . 0.0 110.519 -177.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -63.41 -45.01 92.97 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.492 0.717 . . . . 0.0 110.319 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -54.24 -48.24 71.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.506 0.722 . . . . 0.0 110.246 174.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.3 mt -61.9 -40.69 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.051 0.54 . . . . 0.0 109.82 177.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -61.04 -43.17 99.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.446 0.567 . . . . 0.0 111.26 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.27 -37.89 84.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.456 0.571 . . . . 0.0 110.244 170.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.37 35.72 9.32 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 124.637 1.113 . . . . 0.0 110.323 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -103.9 129.81 51.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.477 0.656 . . . . 0.0 109.876 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.5 p -73.07 160.03 32.68 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.148 0.579 . . . . 0.0 110.491 -175.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -72.76 68.1 0.84 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 167.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.96 -58.11 0.11 Allowed Glycine 0 CA--C 1.524 0.646 0 N-CA-C 106.664 -2.574 . . . . 0.0 106.664 -169.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.32 -50.08 74.06 Favored 'General case' 0 C--N 1.34 0.152 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 169.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 70.6 t -55.53 -43.16 71.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 174.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.66 -51.0 51.47 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.71 -52.9 63.5 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.61 0.764 . . . . 0.0 110.292 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.13 74.06 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.711 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -44.85 92.25 Favored 'General case' 0 C--O 1.224 -0.255 0 O-C-N 121.842 -0.536 . . . . 0.0 110.196 175.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -43.5 -54.29 5.68 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 124.827 1.203 . . . . 0.0 111.374 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -62.56 -50.99 69.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.638 0.375 . . . . 0.0 111.577 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.28 -25.49 36.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -169.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -142.81 -60.74 0.43 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.572 1.149 . . . . 0.0 110.782 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 154.05 139.34 2.82 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 107.021 -2.431 . . . . 0.0 107.021 -169.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -82.24 69.42 8.97 Favored 'General case' 0 C--N 1.337 0.044 0 CA-C-N 118.481 1.141 . . . . 0.0 110.376 -170.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -92.44 35.18 1.02 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.01 0.524 . . . . 0.0 110.441 170.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -134.43 -52.8 0.83 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 121.506 -0.746 . . . . 0.0 111.771 -167.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p 30.36 -98.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.267 2.227 . . . . 0.0 112.567 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tm0? -125.23 -59.96 1.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.807 1.643 . . . . 0.0 108.831 172.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.45 -58.31 7.96 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 123.937 0.895 . . . . 0.0 112.755 -167.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -41.64 99.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.729 0.695 . . . . 0.0 111.342 -177.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -57.59 -47.43 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.964 0.802 . . . . 0.0 110.871 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 m -63.05 -45.97 89.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.961 -0.462 . . . . 0.0 110.17 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -59.2 -40.43 85.75 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.629 0.772 . . . . 0.0 111.485 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -60.52 -55.46 33.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.153 0.581 . . . . 0.0 109.945 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -59.43 -39.22 82.83 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.645 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.09 -5.85 38.27 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 173.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.9 mt 58.52 42.39 21.0 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.707 2.003 . . . . 0.0 111.825 176.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -79.79 -31.51 40.81 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.846 0.858 . . . . 0.0 111.805 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.55 31.05 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.949 1.462 . . . . 0.0 114.949 -168.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 92.3 p 55.06 -80.54 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.515 2.326 . . . . 0.0 113.595 -178.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -174.74 -38.89 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.612 2.365 . . . . 0.0 109.335 -176.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -44.89 -52.18 8.88 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.616 1.166 . . . . 0.0 112.738 -174.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -76.73 -47.09 22.89 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.7 mtt -41.49 -46.9 3.61 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 125.184 1.394 . . . . 0.0 112.334 -177.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 19.5 t -61.42 -27.52 68.61 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -82.64 -51.19 7.97 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -45.1 -46.32 11.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.884 2.074 . . . . 0.0 111.799 -176.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -64.26 -64.02 3.23 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.99 -174.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.56 -37.46 96.99 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 121.476 1.451 . . . . 0.0 111.081 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.98 -56.93 12.31 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.231 0.612 . . . . 0.0 111.027 175.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.9 mt -67.88 -35.56 78.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.103 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.22 -49.75 75.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.834 0.743 . . . . 0.0 109.96 176.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -66.99 -42.01 85.78 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -52.21 -47.55 65.55 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 122.011 -0.43 . . . . 0.0 110.459 170.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -53.42 57.43 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -45.62 -53.56 9.01 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.89 0.876 . . . . 0.0 110.427 174.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.84 -45.71 91.33 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.79 -177.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.63 -51.17 66.41 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.736 0.814 . . . . 0.0 111.134 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 N--CA 1.454 -0.233 0 O-C-N 122.122 -0.361 . . . . 0.0 110.071 -177.126 . . . . . . . . 0 0 . 1 stop_ save_