data_2m9j_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 2m9j _Structure_validation_residue.Date_analyzed 2016-10-08 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' ' ' TRP . . . . . . . . . . . . . 86.7 m95 . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -147.42 145.77 29.35 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.453 1.501 . . . . 0.0 111.192 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -63.78 143.25 58.0 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.879 0.847 . . . . 0.0 111.52 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -144.51 151.45 39.15 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.67 1.188 . . . . 0.0 109.823 -172.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.9 ttm -135.09 130.55 35.7 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.347 0.659 . . . . 0.0 111.967 -172.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -78.31 94.96 4.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.472 1.909 . . . . 0.0 112.582 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -58.66 150.39 23.44 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 169.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 p 80.94 -14.85 0.79 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.364 2.666 . . . . 0.0 115.615 -170.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -136.58 -21.31 1.32 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.67 1.577 . . . . 0.0 115.078 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.42 3.3 72.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.686 1.136 . . . . 0.0 114.275 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -62.8 158.82 17.85 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.468 1.107 . . . . 0.0 110.124 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.4 t -131.59 147.96 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.707 1.603 . . . . 0.0 108.384 -175.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -156.58 -167.61 2.45 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.398 1.879 . . . . 0.0 109.078 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -129.44 150.46 50.78 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.069 1.348 . . . . 0.0 109.148 174.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -135.53 127.56 29.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.528 1.531 . . . . 0.0 109.062 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -86.87 97.3 10.58 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -76.16 1.31 16.1 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.8 mt -94.46 -33.82 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 124.439 1.095 . . . . 0.0 111.543 171.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.3 p -108.17 -21.11 12.92 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.1 5.68 0.52 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 131.328 3.851 . . . . 0.0 114.22 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.08 16.11 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.6 p -137.99 144.46 41.12 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.521 1.529 . . . . 0.0 109.838 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -154.31 146.68 23.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.913 1.685 . . . . 0.0 107.87 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.07 -32.08 17.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.988 0.813 . . . . 0.0 111.381 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.01 143.21 49.25 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.351 1.072 . . . . 0.0 110.196 169.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 125.8 1.64 . . . . 0.0 113.868 -169.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.5 m95 . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -145.04 145.5 31.5 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.046 1.338 . . . . 0.0 111.917 169.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -63.56 145.67 55.21 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.465 1.906 . . . . 0.0 111.98 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -141.51 151.45 43.29 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.495 1.118 . . . . 0.0 110.915 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.0 ttp -134.95 136.82 42.54 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.054 0.942 . . . . 0.0 110.812 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -86.28 104.44 15.82 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.734 1.213 . . . . 0.0 113.839 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 157.54 1.83 Allowed 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.786 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m 66.11 -10.68 0.24 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -171.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -140.8 -21.12 0.8 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 122.22 2.282 . . . . 0.0 116.309 171.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.0 7.07 78.28 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.744 1.156 . . . . 0.0 114.445 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 34.6 m -59.84 158.34 10.74 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.483 1.113 . . . . 0.0 109.502 171.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -135.08 146.88 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.269 1.428 . . . . 0.0 109.011 -174.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -156.12 -169.61 3.11 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.271 1.829 . . . . 0.0 109.541 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.406 ' CD1' ' HB2' ' A' ' 31' ' ' ARG . 1.2 m-85 -129.65 155.35 46.0 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.149 0.98 . . . . 0.0 111.308 174.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -133.32 126.79 32.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.206 1.402 . . . . 0.0 109.185 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -90.49 96.32 10.59 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.374 0.67 . . . . 0.0 109.484 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -70.04 -2.21 12.09 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.5 mt -95.05 -31.72 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 119.325 0.966 . . . . 0.0 111.224 174.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.9 p -105.43 -22.15 13.08 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.661 1.184 . . . . 0.0 113.566 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 79.91 9.16 1.47 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 130.047 3.339 . . . . 0.0 113.261 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.34 160.77 26.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.387 0.994 . . . . 0.0 111.801 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -140.19 143.03 35.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.38 1.072 . . . . 0.0 109.102 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -151.71 140.76 21.17 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.507 0.723 . . . . 0.0 109.939 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -86.82 -42.57 13.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.371 1.069 . . . . 0.0 109.469 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -79.23 87.72 4.93 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 125.412 2.53 . . . . 0.0 108.163 169.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.406 ' HB2' ' CD1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.848 0 CA-C-N 109.899 -3.319 . . . . 0.0 114.39 -171.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.9 m95 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -149.28 142.89 25.46 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.927 1.291 . . . . 0.0 111.909 -172.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -60.31 132.94 55.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.45 150.46 47.63 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.048 1.339 . . . . 0.0 109.419 -172.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.9 ttp -135.2 136.48 41.81 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.828 0.451 . . . . 0.0 112.139 -169.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 60.0 m-85 -75.6 109.5 9.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.571 1.548 . . . . 0.0 112.625 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.32 144.04 13.69 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 114.436 -1.257 . . . . 0.0 110.17 173.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.6 m 64.15 0.43 1.0 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -136.75 -25.63 1.1 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.209 1.822 . . . . 0.0 115.126 169.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.91 3.21 70.77 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 119.216 0.917 . . . . 0.0 114.906 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.3 m -56.01 156.15 5.65 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 109.357 169.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -131.89 148.14 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 C-N-CA 124.969 1.308 . . . . 0.0 108.967 -173.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.402 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.8 p90 -156.42 -170.23 3.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.41 1.884 . . . . 0.0 109.514 178.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -127.71 149.0 50.42 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.635 1.174 . . . . 0.0 108.332 174.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -133.98 127.92 33.33 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.163 1.385 . . . . 0.0 108.898 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -88.99 92.89 9.41 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -71.26 -0.46 9.99 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.3 mt -92.02 -24.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 124.764 1.226 . . . . 0.0 111.47 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.9 p -120.11 -22.46 6.64 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.664 1.586 . . . . 0.0 114.246 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 84.98 7.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 131.205 3.802 . . . . 0.0 114.425 -171.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.07 164.19 18.43 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 119.883 1.22 . . . . 0.0 113.666 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 p -142.49 140.69 31.95 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.297 1.439 . . . . 0.0 111.009 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -151.47 143.67 24.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.456 1.502 . . . . 0.0 108.487 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -83.35 -28.31 29.08 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.756 0.707 . . . . 0.0 112.058 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 136.58 51.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.662 0.744 . . . . 0.0 109.647 169.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp-105 . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 128.227 2.611 . . . . 0.0 116.782 -169.227 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.7 m95 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 121.328 0.585 . . . . 0.0 112.565 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -147.78 144.65 28.37 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.063 1.345 . . . . 0.0 111.364 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -63.09 143.41 57.81 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.866 0.841 . . . . 0.0 111.56 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -147.19 156.73 43.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.028 0.931 . . . . 0.0 110.143 -170.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -134.69 145.05 48.16 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.617 0.767 . . . . 0.0 110.977 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -91.15 114.37 26.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -42.72 133.51 3.48 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.21 2.204 . . . . 0.0 111.363 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m 65.54 1.8 1.82 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -134.96 -17.58 1.87 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 120.653 1.57 . . . . 0.0 114.481 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.39 7.98 87.03 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 119.137 0.88 . . . . 0.0 114.104 173.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 88.6 m -62.42 159.39 15.55 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.439 1.119 . . . . 0.0 109.549 169.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.8 t -131.28 146.9 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 125.939 1.696 . . . . 0.0 108.267 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -159.03 -167.28 2.05 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.858 1.663 . . . . 0.0 109.425 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -129.84 151.22 50.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.868 174.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -137.37 127.67 26.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.369 1.467 . . . . 0.0 109.278 -172.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -86.74 93.71 9.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -72.78 0.77 9.97 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.0 mt -88.89 -26.72 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.188 0.995 . . . . 0.0 111.399 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.4 p -120.1 -24.14 6.1 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.741 1.616 . . . . 0.0 114.668 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 85.13 7.61 0.43 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 131.338 3.855 . . . . 0.0 114.596 -170.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.95 164.43 15.14 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.617 1.099 . . . . 0.0 113.611 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.2 p -137.63 146.94 44.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.555 1.542 . . . . 0.0 110.852 173.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -147.6 154.26 40.44 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 108.595 171.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -90.0 -19.89 23.91 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.437 0.562 . . . . 0.0 111.558 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.36 148.38 51.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 . . . . . 0 CA--C 1.544 0.736 0 C-N-CA 125.538 1.535 . . . . 0.0 113.565 -179.83 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 98.5 m95 . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 162.99 34.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.041 1.336 . . . . 0.0 111.622 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 tmpt? -74.65 131.5 40.95 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.431 0.692 . . . . 0.0 111.473 -177.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -128.27 156.09 43.56 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.298 1.439 . . . . 0.0 110.325 -173.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 14.6 ttt -135.32 143.69 46.31 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.086 0.555 . . . . 0.0 111.462 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -90.38 108.75 19.97 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 147.27 1.06 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.484 1.114 . . . . 0.0 110.918 169.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m 65.0 -5.91 0.37 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -136.15 -17.32 1.6 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.362 1.892 . . . . 0.0 114.754 169.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.16 10.15 84.19 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.788 1.185 . . . . 0.0 114.46 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 m -62.57 162.18 10.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.268 1.034 . . . . 0.0 109.68 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.9 t -128.42 149.01 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.551 1.54 . . . . 0.0 108.342 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -155.3 -163.28 1.5 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.094 2.157 . . . . 0.0 108.17 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -134.17 151.86 51.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 109.025 177.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -134.85 132.56 38.75 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.222 1.409 . . . . 0.0 109.836 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -86.03 97.88 10.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 122.7 0.4 . . . . 0.0 110.027 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -71.7 -9.4 58.21 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 28.1 mt -84.73 -35.25 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 124.443 1.097 . . . . 0.0 111.758 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -112.56 -20.1 11.85 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 85.15 6.29 0.49 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 131.039 3.736 . . . . 0.0 114.424 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.49 165.8 16.01 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -139.61 140.71 37.06 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.613 1.565 . . . . 0.0 111.424 173.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -150.79 149.98 30.41 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.822 1.649 . . . . 0.0 107.933 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.24 -32.7 16.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.185 0.902 . . . . 0.0 111.412 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.5 145.25 56.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.084 0.857 . . . . 0.0 110.2 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 C-N-CA 125.238 1.415 . . . . 0.0 113.123 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -149.72 146.32 27.16 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.649 1.179 . . . . 0.0 110.097 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -67.81 144.72 55.22 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.517 0.675 . . . . 0.0 109.939 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -142.85 152.92 42.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.835 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.0 ttm -135.03 137.47 42.99 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -86.22 100.77 12.47 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.893 1.277 . . . . 0.0 113.545 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.88 146.74 3.08 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.151 0.98 . . . . 0.0 110.394 169.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.2 p 73.13 -9.99 1.07 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.509 2.324 . . . . 0.0 117.036 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -136.22 -21.3 1.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 120.87 1.668 . . . . 0.0 115.239 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.96 5.91 80.15 Favored Glycine 0 CA--C 1.533 1.191 0 CA-C-N 119.312 0.96 . . . . 0.0 114.399 173.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.0 m -61.56 159.55 12.88 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.371 1.069 . . . . 0.0 109.803 172.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -134.41 144.81 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.445 1.498 . . . . 0.0 108.449 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -153.91 -166.69 2.45 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.691 2.396 . . . . 0.0 109.027 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -132.05 151.33 51.82 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.939 0.896 . . . . 0.0 109.966 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -137.39 127.57 26.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.122 1.369 . . . . 0.0 110.012 -172.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -90.78 95.29 10.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.254 0.622 . . . . 0.0 109.565 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -75.11 3.37 8.69 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.293 1.59 . . . . 0.0 115.293 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.8 mt -90.93 -29.85 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 118.864 0.756 . . . . 0.0 111.44 170.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.3 p -112.14 -23.12 10.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.84 1.256 . . . . 0.0 113.787 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 82.9 8.33 0.72 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 130.758 3.623 . . . . 0.0 113.851 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.21 163.05 21.21 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.509 1.049 . . . . 0.0 112.874 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 p -141.61 138.36 32.54 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.029 1.332 . . . . 0.0 110.255 173.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -135.04 148.4 49.89 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.138 172.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.14 -19.94 24.88 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 173.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.1 124.91 25.05 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.068 2.147 . . . . 0.0 107.694 169.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 116.984 -1.484 . . . . 0.0 109.241 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.6 m95 . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -150.2 143.48 25.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.906 1.282 . . . . 0.0 110.989 -173.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -66.2 138.94 58.04 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.516 -0.74 . . . . 0.0 111.71 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.55 154.6 47.67 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.151 1.38 . . . . 0.0 110.626 -169.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 33.8 ttp -135.11 130.25 35.18 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.844 0.858 . . . . 0.0 112.061 -173.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -76.72 97.56 4.51 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.054 1.742 . . . . 0.0 112.666 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -58.95 141.33 54.0 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 169.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 59.1 p 89.43 -14.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 129.497 3.119 . . . . 0.0 115.031 -174.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -137.42 -16.56 1.37 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.23 89.32 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.175 0.898 . . . . 0.0 114.248 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 98.9 m -64.07 160.44 18.12 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.534 1.167 . . . . 0.0 110.241 172.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 t -131.27 147.76 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 126.003 1.721 . . . . 0.0 108.775 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -157.64 -166.06 1.92 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.603 1.961 . . . . 0.0 109.03 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -132.05 150.54 52.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.188 1.395 . . . . 0.0 108.723 175.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -137.76 128.26 26.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.705 1.202 . . . . 0.0 109.249 -172.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -86.59 96.91 10.26 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -73.92 -3.96 32.15 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mt -89.58 -33.34 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 124.514 1.126 . . . . 0.0 111.609 172.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.4 p -109.42 -20.94 12.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 85.02 5.42 0.54 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 131.44 3.896 . . . . 0.0 114.376 -172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.41 163.86 19.92 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.7 p -137.76 141.06 40.95 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.519 1.528 . . . . 0.0 111.09 171.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -148.45 147.69 29.43 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.325 1.85 . . . . 0.0 107.359 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.16 -28.78 19.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.158 0.89 . . . . 0.0 110.808 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 144.94 53.4 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.739 0.78 . . . . 0.0 109.983 169.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 C-N-CA 126.694 1.998 . . . . 0.0 114.73 -171.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.0 m95 . . . . . 0 N--CA 1.465 0.311 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -149.37 148.38 29.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.354 1.462 . . . . 0.0 110.439 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -65.73 144.87 56.62 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.97 0.804 . . . . 0.0 111.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -145.97 153.59 40.96 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.546 0.739 . . . . 0.0 110.443 -171.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.5 ttm -130.98 132.76 45.24 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.642 0.777 . . . . 0.0 110.786 -176.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -76.61 106.7 8.42 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.781 1.632 . . . . 0.0 113.007 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.95 146.8 13.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.578 169.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.3 p 73.82 -9.14 1.27 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.208 2.203 . . . . 0.0 116.805 -175.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.71 -20.88 0.91 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 169.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.44 4.55 80.27 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-N 119.652 1.114 . . . . 0.0 114.543 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 m -59.68 160.04 7.85 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.612 1.165 . . . . 0.0 109.899 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -129.73 147.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 125.237 1.415 . . . . 0.0 108.779 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -159.05 -168.16 2.29 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.191 1.796 . . . . 0.0 109.294 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -129.0 149.28 50.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.699 1.199 . . . . 0.0 108.843 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -139.02 126.1 21.21 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.361 1.464 . . . . 0.0 109.314 -169.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -85.85 93.58 8.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -72.55 0.5 10.27 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.8 mt -89.56 -25.91 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.14 0.976 . . . . 0.0 111.428 173.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.7 p -120.09 -23.92 6.17 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.463 1.505 . . . . 0.0 114.485 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 85.08 7.41 0.45 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 131.371 3.869 . . . . 0.0 114.544 -170.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.14 15.99 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.705 1.139 . . . . 0.0 113.544 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.9 p -141.4 142.67 33.72 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.088 1.355 . . . . 0.0 111.85 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -149.65 146.54 27.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.585 1.554 . . . . 0.0 107.985 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -84.6 -28.28 26.65 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.394 0.997 . . . . 0.0 112.465 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.09 148.01 40.11 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.219 0.918 . . . . 0.0 110.617 169.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.053 1.341 . . . . 0.0 114.057 -169.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 . . . . . 0 CA--C 1.537 0.453 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -151.04 152.61 33.72 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.987 1.315 . . . . 0.0 110.182 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 136.68 57.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.72 2.008 . . . . 0.0 112.266 -172.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.403 ' HE ' ' HB3' ' A' ' 20' ' ' PHE . 1.8 tpp180 -135.24 152.32 51.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.421 1.088 . . . . 0.0 110.348 -174.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 13.7 ttt -135.23 130.53 35.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.127 0.571 . . . . 0.0 111.701 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 67.6 m-85 -79.38 95.02 5.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.724 1.209 . . . . 0.0 113.596 -176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -58.31 141.41 51.11 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 90.45 -13.33 0.28 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 129.427 3.091 . . . . 0.0 114.954 -169.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -143.36 -21.35 0.61 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.982 1.719 . . . . 0.0 115.411 169.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.52 77.56 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 125.215 1.388 . . . . 0.0 114.754 175.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 m -59.71 162.08 5.59 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.555 1.142 . . . . 0.0 109.982 171.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.8 t -129.8 148.54 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 125.586 1.554 . . . . 0.0 108.084 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 8.1 p90 -155.97 -163.47 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.35 2.26 . . . . 0.0 108.126 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -136.51 153.22 51.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.719 1.208 . . . . 0.0 109.388 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.403 ' HB3' ' HE ' ' A' ' 9' ' ' ARG . 77.2 t80 -140.87 127.33 19.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.722 1.209 . . . . 0.0 109.514 -170.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -79.99 98.45 7.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -69.98 -10.18 57.74 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.1 mt -87.06 -35.5 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.593 1.157 . . . . 0.0 111.729 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.3 p -110.17 -21.98 12.0 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 85.01 7.33 0.46 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 130.836 3.654 . . . . 0.0 114.091 -172.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.67 163.57 18.74 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.27 0.941 . . . . 0.0 113.35 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.5 p -135.95 144.44 45.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.283 1.433 . . . . 0.0 111.516 174.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -144.92 154.46 42.62 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.856 1.662 . . . . 0.0 107.597 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -90.1 -19.92 23.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.671 0.669 . . . . 0.0 110.099 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.61 144.47 57.19 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 169.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.677 0 C-N-CA 127.27 2.228 . . . . 0.0 114.153 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 98.4 m95 . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.426 0.631 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.99 142.76 30.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.383 1.473 . . . . 0.0 111.189 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -62.91 144.51 56.67 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 122.068 0.937 . . . . 0.0 111.811 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -146.65 153.37 40.23 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.022 0.929 . . . . 0.0 110.063 -169.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 35.2 ttm -133.42 129.81 37.83 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.106 0.562 . . . . 0.0 111.923 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.3 96.31 2.8 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.782 1.633 . . . . 0.0 111.478 173.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt-85 -59.75 155.58 15.7 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.046 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.1 t 65.84 -4.87 0.57 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -136.24 -20.3 1.43 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 121.376 1.898 . . . . 0.0 114.299 169.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.83 3.18 88.2 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.626 1.108 . . . . 0.0 114.157 172.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 93.2 m -65.87 158.38 28.08 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.364 1.082 . . . . 0.0 109.988 173.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.6 t -135.0 142.71 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.914 1.686 . . . . 0.0 108.269 -173.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -154.11 -166.05 2.26 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 127.156 2.182 . . . . 0.0 108.738 -172.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -131.47 151.94 51.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.439 1.096 . . . . 0.0 110.394 176.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -137.97 127.27 24.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.446 1.498 . . . . 0.0 109.23 -173.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -86.55 94.38 9.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -74.02 0.6 13.14 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.93 -27.68 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.037 0.935 . . . . 0.0 111.286 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.8 p -120.06 -24.29 6.08 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.899 1.68 . . . . 0.0 114.864 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 85.22 8.33 0.4 Allowed 'General case' 0 CA--C 1.549 0.935 1 C-N-CA 131.711 4.004 . . . . 0.0 114.685 -169.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.54 167.18 13.38 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 119.815 1.189 . . . . 0.0 114.043 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.8 p -140.18 143.53 36.14 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.937 1.695 . . . . 0.0 111.318 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 155.14 43.96 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.129 1.371 . . . . 0.0 107.799 171.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.03 -19.95 23.81 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.945 175.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -71.59 151.94 43.35 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.127 1.33 . . . . 0.0 109.309 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.964 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.9 m95 . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -152.37 148.75 27.86 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.354 1.062 . . . . 0.0 112.027 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 128.2 34.93 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.594 2.358 . . . . 0.0 112.164 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.59 156.28 46.04 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.189 1.395 . . . . 0.0 109.56 -170.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.9 ttm -135.06 142.21 46.27 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.237 0.615 . . . . 0.0 111.256 -172.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.405 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 75.1 m-85 -89.63 99.79 12.72 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.859 1.263 . . . . 0.0 113.373 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.28 147.64 2.2 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.128 0.971 . . . . 0.0 110.728 169.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.3 p 72.31 -10.5 0.9 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 127.489 2.315 . . . . 0.0 116.945 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -134.71 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.961 1.709 . . . . 0.0 114.945 169.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.67 5.94 80.91 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 119.055 0.843 . . . . 0.0 114.257 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 m -61.02 158.83 12.66 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.157 0.983 . . . . 0.0 109.682 172.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 t -132.53 148.26 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.58 1.552 . . . . 0.0 108.278 -177.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 6.8 p90 -157.4 -165.09 1.71 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.709 2.004 . . . . 0.0 108.245 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -130.84 154.07 48.43 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.522 1.129 . . . . 0.0 110.384 173.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.87 130.59 27.6 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.991 -1.459 . . . . 0.0 109.068 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -85.02 95.29 9.04 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -69.32 -0.21 5.93 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.0 mt -100.48 -27.2 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.428 1.091 . . . . 0.0 111.776 177.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -112.19 -24.45 9.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.142 1.377 . . . . 0.0 113.85 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 83.84 8.28 0.58 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 130.143 3.377 . . . . 0.0 113.707 -169.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.35 165.62 11.49 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.504 1.047 . . . . 0.0 112.741 176.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 p -139.52 154.02 47.59 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.946 1.299 . . . . 0.0 110.448 174.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -149.93 151.31 33.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.306 1.442 . . . . 0.0 107.805 169.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -87.01 -19.63 28.4 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.476 0.58 . . . . 0.0 109.724 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.22 128.5 35.87 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 168.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 -169.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 96.0 m95 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 121.192 0.52 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -147.0 150.61 35.48 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.218 1.007 . . . . 0.0 111.133 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.79 134.76 42.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.011 2.124 . . . . 0.0 112.88 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -135.77 152.78 51.46 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.202 1.401 . . . . 0.0 109.531 -178.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.7 ttt -135.17 129.74 34.27 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.018 0.527 . . . . 0.0 111.915 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 44.9 m-85 -81.03 119.04 23.02 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -169.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -55.95 150.95 12.52 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.115 -1.402 . . . . 0.0 110.365 171.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 m 67.26 -3.75 0.97 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -147.17 -21.09 0.4 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 121.751 2.069 . . . . 0.0 116.468 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.78 77.16 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 119.867 1.212 . . . . 0.0 115.169 177.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 50.6 m -54.9 158.76 2.59 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.438 1.495 . . . . 0.0 109.519 170.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.16 148.47 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 125.122 1.369 . . . . 0.0 108.931 -176.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.6 p90 -156.88 -169.51 3.0 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.577 1.551 . . . . 0.0 109.166 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -125.83 149.14 48.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 122.503 1.144 . . . . 0.0 109.054 172.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -139.0 124.38 19.28 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.829 1.652 . . . . 0.0 108.139 -172.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -75.73 99.35 4.35 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.995 174.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -68.86 -9.72 53.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.8 mt -94.09 -31.14 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.756 1.622 . . . . 0.0 112.01 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -116.5 -11.1 11.15 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 68.58 10.67 8.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.125 2.97 . . . . 0.0 115.279 -172.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.68 160.88 13.3 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.006 0.821 . . . . 0.0 112.927 170.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 p -143.44 146.21 33.26 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.925 1.29 . . . . 0.0 111.447 175.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -158.2 138.7 12.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.095 1.358 . . . . 0.0 109.005 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -82.77 -19.7 37.29 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.187 -0.946 . . . . 0.0 112.114 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -77.92 142.01 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.905 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -169.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.4 m95 . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -151.61 152.5 32.95 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.395 1.078 . . . . 0.0 110.542 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 135.55 57.28 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.613 1.965 . . . . 0.0 112.706 -175.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -136.93 156.75 48.06 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.955 1.302 . . . . 0.0 110.168 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.0 ttt -135.09 139.03 44.38 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.345 0.658 . . . . 0.0 111.203 -173.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.4 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 62.3 m-85 -86.52 103.01 14.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.564 1.146 . . . . 0.0 113.418 -178.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.05 134.63 52.7 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.182 169.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 t 90.19 -7.83 0.35 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.699 2.8 . . . . 0.0 115.743 -178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -141.71 -15.43 0.82 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.41 1.459 . . . . 0.0 114.224 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.73 11.19 83.35 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.383 0.992 . . . . 0.0 114.236 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 51.8 m -64.46 163.61 13.02 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.358 1.079 . . . . 0.0 110.205 170.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.2 t -130.49 149.77 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 125.707 1.603 . . . . 0.0 108.658 -175.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.5 p90 -156.26 -168.23 2.67 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.615 1.966 . . . . 0.0 109.091 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -128.63 149.66 50.56 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.755 1.222 . . . . 0.0 108.519 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -139.22 126.85 21.84 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.272 1.429 . . . . 0.0 108.899 -170.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -78.92 97.63 6.09 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 123.592 0.558 . . . . 0.0 109.713 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -68.89 -7.78 37.88 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.1 mt -92.98 -33.41 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 125.355 1.462 . . . . 0.0 111.76 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.9 p -111.47 -22.31 11.34 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 85.11 6.93 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 130.913 3.685 . . . . 0.0 114.325 -172.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.05 161.78 20.91 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.519 1.054 . . . . 0.0 113.498 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.8 p -136.94 140.98 42.64 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.111 1.364 . . . . 0.0 112.08 174.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -147.15 141.62 26.46 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.114 1.766 . . . . 0.0 107.873 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -81.14 -28.54 35.03 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.507 1.049 . . . . 0.0 112.629 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.14 150.44 37.19 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.08 0.854 . . . . 0.0 110.581 169.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 C-N-CA 127.463 2.305 . . . . 0.0 113.563 -169.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 m95 . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 8' ' ' LYS . 12.0 tp10 -165.05 163.12 20.65 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.878 2.071 . . . . 0.0 110.742 169.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.493 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.6 ttpm? -49.74 145.63 5.08 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 130.55 3.54 . . . . 0.0 114.521 177.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -141.72 159.57 41.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.397 1.879 . . . . 0.0 109.031 171.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 34.4 ttp -131.94 140.34 48.98 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.338 1.055 . . . . 0.0 110.557 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.429 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 75.4 m-85 -87.27 95.9 10.15 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.829 1.252 . . . . 0.0 113.351 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.33 146.45 28.87 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 169.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.2 p 90.32 -16.82 0.21 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 130.111 3.364 . . . . 0.0 115.098 -169.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -144.23 -19.56 0.56 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.967 1.84 . . . . 0.0 115.967 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.88 6.99 71.47 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-N 119.939 1.245 . . . . 0.0 114.712 178.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -58.35 158.04 7.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 0.0 109.61 170.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.1 t -134.61 148.87 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 125.716 1.606 . . . . 0.0 108.528 -175.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.429 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 10.5 p90 -156.16 -176.47 5.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.611 1.564 . . . . 0.0 109.277 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -123.73 141.39 52.07 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.9 1.333 . . . . 0.0 108.617 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -133.59 136.63 45.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 113.518 -1.674 . . . . 0.0 108.925 -169.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -86.16 92.29 8.7 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 169.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -65.99 2.0 1.25 Allowed 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mp -105.12 -47.55 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.63 1.172 . . . . 0.0 110.969 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.7 p -85.65 -28.85 24.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.539 1.135 . . . . 0.0 113.523 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 85.02 11.97 0.27 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 130.337 3.455 . . . . 0.0 115.019 -172.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.74 19.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.29 0.95 . . . . 0.0 112.322 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.5 p -145.09 136.38 25.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.538 1.135 . . . . 0.0 111.506 176.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -135.15 159.43 41.56 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -84.44 -22.49 30.33 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.745 -1.222 . . . . 0.0 109.338 170.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.24 124.48 24.24 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.712 2.005 . . . . 0.0 109.821 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.625 0 C-N-CA 127.211 2.204 . . . . 0.0 110.646 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.6 m95 . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -146.09 141.89 28.0 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.438 1.495 . . . . 0.0 110.555 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -66.32 138.76 57.85 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 121.65 -0.656 . . . . 0.0 111.512 -174.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.67 154.29 48.61 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.279 1.432 . . . . 0.0 109.906 -169.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 22.5 ttp -134.14 137.33 44.44 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.63 0.772 . . . . 0.0 111.183 -172.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -82.27 102.14 10.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.662 1.185 . . . . 0.0 112.19 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -54.16 152.57 5.95 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.306 169.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.6 t 65.5 -4.1 0.61 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -173.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -138.87 -18.87 1.03 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.553 1.978 . . . . 0.0 114.95 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.33 6.54 89.21 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.09 0.852 . . . . 0.0 114.305 173.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.0 m -65.58 160.98 21.26 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.345 1.072 . . . . 0.0 110.197 171.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -134.3 147.31 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 125.868 1.667 . . . . 0.0 109.078 -173.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -156.61 -166.62 2.17 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.658 1.983 . . . . 0.0 108.968 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -131.44 150.92 51.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.432 1.093 . . . . 0.0 109.256 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -133.46 128.3 35.14 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 108.897 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -89.59 96.5 10.73 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.6 p80 -74.63 -1.42 21.58 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.8 mt -92.41 -34.04 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 124.571 1.148 . . . . 0.0 111.547 172.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.2 p -105.55 -21.69 13.15 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.06 6.55 0.48 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 131.407 3.883 . . . . 0.0 114.12 -172.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.99 165.13 20.78 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.5 p -140.32 138.94 35.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.632 1.573 . . . . 0.0 110.257 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -150.0 147.21 27.57 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.42 1.488 . . . . 0.0 108.38 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -90.09 -30.99 17.32 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.634 1.106 . . . . 0.0 110.666 -175.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.72 124.89 21.95 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.707 2.003 . . . . 0.0 108.227 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? . . . . . 0 CA--C 1.538 0.507 0 C-N-CA 125.087 1.355 . . . . 0.0 113.188 -169.425 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -150.72 154.56 37.63 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.828 1.251 . . . . 0.0 110.174 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.72 145.0 46.6 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.231 1.413 . . . . 0.0 111.861 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.5 155.29 43.01 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.18 -0.95 . . . . 0.0 110.67 -178.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.3 ttt -135.23 142.68 46.04 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.234 0.614 . . . . 0.0 111.365 -172.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -95.29 98.12 10.36 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.572 1.149 . . . . 0.0 113.754 -177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.3 146.62 18.78 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.901 169.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 p 90.04 -19.83 0.16 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 129.67 3.188 . . . . 0.0 114.806 -170.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -141.88 -20.31 0.73 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.48 10.27 77.34 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-N 119.385 0.993 . . . . 0.0 114.727 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.2 m -58.07 160.49 4.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.718 1.207 . . . . 0.0 109.8 170.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.67 149.86 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.575 1.55 . . . . 0.0 108.527 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -155.79 -168.09 2.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.58 1.952 . . . . 0.0 109.745 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -131.35 149.17 52.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.058 1.343 . . . . 0.0 108.961 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -137.1 127.44 26.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.073 1.749 . . . . 0.0 109.395 -171.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.21 99.41 7.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.133 173.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -72.03 -5.98 39.02 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.2 mt -93.61 -33.35 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.071 1.348 . . . . 0.0 111.723 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.5 p -111.29 -22.42 11.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 85.08 7.52 0.44 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.84 3.656 . . . . 0.0 114.452 -173.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.26 163.27 18.3 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 119.361 0.982 . . . . 0.0 113.568 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.6 p -144.96 137.89 26.45 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.914 1.285 . . . . 0.0 112.268 175.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.86 160.13 44.09 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.818 1.247 . . . . 0.0 109.818 169.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -87.94 -27.15 22.3 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -169.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.89 158.54 23.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.77 1.168 . . . . 0.0 111.449 172.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.7 m95 . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -148.28 153.5 38.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.264 1.426 . . . . 0.0 109.829 178.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.89 145.27 36.06 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.431 1.492 . . . . 0.0 111.608 -179.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.47 152.45 39.8 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.802 -1.186 . . . . 0.0 110.286 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.6 ttt -135.26 137.01 42.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.791 0.436 . . . . 0.0 111.929 -172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -86.83 95.03 9.72 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 125.446 1.499 . . . . 0.0 112.869 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 144.24 42.25 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.2 p 89.98 -16.24 0.24 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.773 3.229 . . . . 0.0 115.061 -171.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -138.81 -20.47 1.0 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 169.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.8 7.15 78.73 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.294 1.426 . . . . 0.0 114.719 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 41.9 m -60.11 160.16 8.56 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 109.947 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.4 t -131.09 149.41 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 125.631 1.573 . . . . 0.0 107.994 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.75 -168.53 2.93 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.731 2.012 . . . . 0.0 108.577 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -131.14 153.02 49.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 122.113 0.958 . . . . 0.0 108.779 172.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -135.08 128.56 32.45 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.757 2.023 . . . . 0.0 109.156 -172.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -84.09 100.13 10.92 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -71.92 -3.95 25.48 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.9 mt -98.17 -32.34 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 125.387 1.475 . . . . 0.0 111.831 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.7 p -113.48 -13.43 12.81 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 79.23 1.23 2.34 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 129.164 2.986 . . . . 0.0 114.147 -176.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 162.48 9.84 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -140.22 137.51 34.35 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.505 1.522 . . . . 0.0 110.978 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -145.17 144.44 30.87 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.428 1.491 . . . . 0.0 108.207 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -80.64 -19.86 44.41 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.686 -0.634 . . . . 0.0 112.329 -177.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -64.61 154.99 34.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 169.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mtp-105 . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 125.148 1.379 . . . . 0.0 112.706 171.584 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 117.362 -1.304 . . . . 0.0 108.304 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.423 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.251 0.3 OUTLIER -74.54 165.35 54.39 Favored Pre-proline 0 CA--C 1.559 1.301 0 CA-C-N 119.685 1.13 . . . . 0.0 110.142 169.714 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.423 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 73.1 Cg_exo -65.31 159.92 44.95 Favored 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.285 4.657 . . . . 0.0 119.874 -169.696 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -53.84 140.37 67.98 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.513 2.809 . . . . 0.0 107.517 168.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.55 -35.79 4.62 Favored Glycine 0 CA--C 1.524 0.611 0 CA-C-O 116.966 -2.019 . . . . 0.0 111.05 -169.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.566 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 86.7 m95 -69.56 139.33 53.72 Favored 'General case' 0 C--N 1.354 0.776 0 CA-C-N 120.707 2.254 . . . . 0.0 113.43 169.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -147.42 145.77 29.35 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.453 1.501 . . . . 0.0 111.192 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -63.78 143.25 58.0 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.879 0.847 . . . . 0.0 111.52 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -144.51 151.45 39.15 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.67 1.188 . . . . 0.0 109.823 -172.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.9 ttm -135.09 130.55 35.7 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.347 0.659 . . . . 0.0 111.967 -172.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.418 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 79.5 m-85 -78.31 94.96 4.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.472 1.909 . . . . 0.0 112.582 176.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -58.66 150.39 23.44 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 169.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 p 80.94 -14.85 0.79 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.364 2.666 . . . . 0.0 115.615 -170.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -136.58 -21.31 1.32 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.67 1.577 . . . . 0.0 115.078 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.42 3.3 72.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.686 1.136 . . . . 0.0 114.275 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -62.8 158.82 17.85 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.468 1.107 . . . . 0.0 110.124 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.4 t -131.59 147.96 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.707 1.603 . . . . 0.0 108.384 -175.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -156.58 -167.61 2.45 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.398 1.879 . . . . 0.0 109.078 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.411 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 4.7 m-85 -129.44 150.46 50.78 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.069 1.348 . . . . 0.0 109.148 174.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -135.53 127.56 29.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.528 1.531 . . . . 0.0 109.062 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -86.87 97.3 10.58 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -76.16 1.31 16.1 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.8 mt -94.46 -33.82 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 124.439 1.095 . . . . 0.0 111.543 171.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.3 p -108.17 -21.11 12.92 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.1 5.68 0.52 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 131.328 3.851 . . . . 0.0 114.22 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.08 16.11 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.6 p -137.99 144.46 41.12 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.521 1.529 . . . . 0.0 109.838 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -154.31 146.68 23.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.913 1.685 . . . . 0.0 107.87 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.07 -32.08 17.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.988 0.813 . . . . 0.0 111.381 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.01 143.21 49.25 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.351 1.072 . . . . 0.0 110.196 169.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.5 116.6 66.76 Favored Pre-proline 0 CA--C 1.538 0.49 0 C-N-CA 125.8 1.64 . . . . 0.0 113.868 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.566 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 18.6 Cg_exo -53.56 -24.93 30.79 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.796 2.997 . . . . 0.0 116.833 170.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.2 p -114.09 -82.06 0.6 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.413 1.485 . . . . 0.0 110.273 169.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.431 0 C-N-CA 124.831 1.205 . . . . 0.0 114.525 -176.771 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.452 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 mtmm . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.584 0.706 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 18.8 mt -148.24 177.43 1.79 Allowed Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 129.033 2.933 . . . . 0.0 107.641 -169.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -53.9 159.92 6.57 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.146 1.897 . . . . 0.0 114.409 -169.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -30.45 100.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 1 C-N-CA 125.636 4.224 . . . . 0.0 117.014 -169.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.08 -25.13 17.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 127.644 2.545 . . . . 0.0 115.77 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -72.05 129.07 37.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.077 2.439 . . . . 0.0 116.317 -169.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -145.04 145.5 31.5 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.046 1.338 . . . . 0.0 111.917 169.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HZ1' ' C ' ' A' ' 34' ' ' GLY . 16.2 ttmm -63.56 145.67 55.21 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.465 1.906 . . . . 0.0 111.98 -174.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -141.51 151.45 43.29 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.495 1.118 . . . . 0.0 110.915 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.0 ttp -134.95 136.82 42.54 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.054 0.942 . . . . 0.0 110.812 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.483 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 68.1 m-85 -86.28 104.44 15.82 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.734 1.213 . . . . 0.0 113.839 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 157.54 1.83 Allowed 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.786 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m 66.11 -10.68 0.24 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -171.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -140.8 -21.12 0.8 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 122.22 2.282 . . . . 0.0 116.309 171.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.0 7.07 78.28 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.744 1.156 . . . . 0.0 114.445 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 34.6 m -59.84 158.34 10.74 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.483 1.113 . . . . 0.0 109.502 171.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -135.08 146.88 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.269 1.428 . . . . 0.0 109.011 -174.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -156.12 -169.61 3.11 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.271 1.829 . . . . 0.0 109.541 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.406 ' CD1' ' HB2' ' A' ' 31' ' ' ARG . 1.2 m-85 -129.65 155.35 46.0 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.149 0.98 . . . . 0.0 111.308 174.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -133.32 126.79 32.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.206 1.402 . . . . 0.0 109.185 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -90.49 96.32 10.59 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.374 0.67 . . . . 0.0 109.484 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -70.04 -2.21 12.09 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.5 mt -95.05 -31.72 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 119.325 0.966 . . . . 0.0 111.224 174.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.9 p -105.43 -22.15 13.08 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.661 1.184 . . . . 0.0 113.566 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 79.91 9.16 1.47 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 130.047 3.339 . . . . 0.0 113.261 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.34 160.77 26.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.387 0.994 . . . . 0.0 111.801 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -140.19 143.03 35.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.38 1.072 . . . . 0.0 109.102 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -151.71 140.76 21.17 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.507 0.723 . . . . 0.0 109.939 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -86.82 -42.57 13.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.371 1.069 . . . . 0.0 109.469 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -79.23 87.72 4.93 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 125.412 2.53 . . . . 0.0 108.163 169.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.406 ' HB2' ' CD1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -76.18 142.65 72.25 Favored Pre-proline 0 C--N 1.316 -0.848 0 CA-C-N 109.899 -3.319 . . . . 0.0 114.39 -171.326 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -52.65 165.07 1.22 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.06 1.173 . . . . 0.0 109.974 169.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 m -55.71 72.45 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.644 2.831 . . . . 0.0 118.644 -169.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.431 ' C ' ' HZ1' ' A' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.472 1.095 0 C-N-CA 125.241 1.4 . . . . 0.0 114.917 169.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.483 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.545 ' H2 ' ' C ' ' A' ' 34' ' ' GLY . 39.6 mtpt . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 116.761 -1.59 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.403 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.284 0.4 OUTLIER -138.89 161.58 57.36 Favored Pre-proline 0 CA--C 1.556 1.18 0 CA-C-N 120.392 1.451 . . . . 0.0 112.948 178.193 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 76.7 Cg_exo -66.98 160.57 46.54 Favored 'Trans proline' 0 CA--C 1.543 0.954 1 C-N-CA 126.49 4.794 . . . . 0.0 120.44 -169.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -58.24 140.64 95.07 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.133 2.555 . . . . 0.0 105.805 168.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.83 -32.57 6.47 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 116.59 -2.228 . . . . 0.0 110.76 -168.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.554 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.9 m95 -71.76 137.96 48.07 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 121.215 2.508 . . . . 0.0 112.665 169.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -149.28 142.89 25.46 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.927 1.291 . . . . 0.0 111.909 -172.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -60.31 132.94 55.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.45 150.46 47.63 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.048 1.339 . . . . 0.0 109.419 -172.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.9 ttp -135.2 136.48 41.81 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.828 0.451 . . . . 0.0 112.139 -169.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 60.0 m-85 -75.6 109.5 9.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.571 1.548 . . . . 0.0 112.625 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.32 144.04 13.69 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 114.436 -1.257 . . . . 0.0 110.17 173.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.6 m 64.15 0.43 1.0 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -136.75 -25.63 1.1 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.209 1.822 . . . . 0.0 115.126 169.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.91 3.21 70.77 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 119.216 0.917 . . . . 0.0 114.906 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.3 m -56.01 156.15 5.65 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 109.357 169.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -131.89 148.14 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 C-N-CA 124.969 1.308 . . . . 0.0 108.967 -173.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.402 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.8 p90 -156.42 -170.23 3.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.41 1.884 . . . . 0.0 109.514 178.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -127.71 149.0 50.42 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.635 1.174 . . . . 0.0 108.332 174.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -133.98 127.92 33.33 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.163 1.385 . . . . 0.0 108.898 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -88.99 92.89 9.41 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -71.26 -0.46 9.99 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.3 mt -92.02 -24.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 124.764 1.226 . . . . 0.0 111.47 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.9 p -120.11 -22.46 6.64 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.664 1.586 . . . . 0.0 114.246 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 84.98 7.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 131.205 3.802 . . . . 0.0 114.425 -171.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.07 164.19 18.43 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 119.883 1.22 . . . . 0.0 113.666 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 p -142.49 140.69 31.95 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.297 1.439 . . . . 0.0 111.009 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -151.47 143.67 24.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.456 1.502 . . . . 0.0 108.487 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -83.35 -28.31 29.08 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.756 0.707 . . . . 0.0 112.058 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.488 ' CD ' ' HZ1' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -69.37 136.58 51.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.662 0.744 . . . . 0.0 109.647 169.757 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp-105 -90.3 110.77 43.05 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 128.227 2.611 . . . . 0.0 116.782 -169.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.554 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 74.8 Cg_exo -61.0 171.06 4.1 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.401 2.067 . . . . 0.0 112.195 169.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.4 p 175.19 72.72 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 172.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.545 ' C ' ' H2 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 CA--C 1.533 1.192 0 N-CA-C 107.065 -2.414 . . . . 0.0 107.065 -168.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.475 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.486 ' HB3' ' CD ' ' A' ' 3' ' ' PRO . 0.7 OUTLIER -139.73 165.83 28.36 Favored Pre-proline 0 CA--C 1.566 1.567 0 C-N-CA 127.229 2.212 . . . . 0.0 108.838 174.406 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.486 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 93.8 Cg_exo -63.1 166.12 15.24 Favored 'Trans proline' 0 CA--C 1.551 1.36 1 C-N-CA 128.142 5.895 . . . . 0.0 121.586 -172.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -55.0 140.43 79.87 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 123.496 2.798 . . . . 0.0 107.463 168.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.5 -33.79 5.75 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.419 -1.212 . . . . 0.0 110.185 -169.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.468 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 97.7 m95 -76.5 140.61 41.26 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 118.999 1.399 . . . . 0.0 112.565 169.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -147.78 144.65 28.37 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.063 1.345 . . . . 0.0 111.364 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -63.09 143.41 57.81 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.866 0.841 . . . . 0.0 111.56 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -147.19 156.73 43.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.028 0.931 . . . . 0.0 110.143 -170.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -134.69 145.05 48.16 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.617 0.767 . . . . 0.0 110.977 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.444 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 57.0 m-85 -91.15 114.37 26.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -42.72 133.51 3.48 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.21 2.204 . . . . 0.0 111.363 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m 65.54 1.8 1.82 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -134.96 -17.58 1.87 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 120.653 1.57 . . . . 0.0 114.481 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.39 7.98 87.03 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 119.137 0.88 . . . . 0.0 114.104 173.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 88.6 m -62.42 159.39 15.55 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.439 1.119 . . . . 0.0 109.549 169.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.8 t -131.28 146.9 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 125.939 1.696 . . . . 0.0 108.267 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -159.03 -167.28 2.05 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.858 1.663 . . . . 0.0 109.425 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.414 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.3 m-85 -129.84 151.22 50.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.868 174.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -137.37 127.67 26.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.369 1.467 . . . . 0.0 109.278 -172.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -86.74 93.71 9.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -72.78 0.77 9.97 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.0 mt -88.89 -26.72 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.188 0.995 . . . . 0.0 111.399 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.4 p -120.1 -24.14 6.1 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.741 1.616 . . . . 0.0 114.668 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 85.13 7.61 0.43 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 131.338 3.855 . . . . 0.0 114.596 -170.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.95 164.43 15.14 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.617 1.099 . . . . 0.0 113.611 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.2 p -137.63 146.94 44.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.555 1.542 . . . . 0.0 110.852 173.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -147.6 154.26 40.44 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 108.595 171.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -90.0 -19.89 23.91 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.437 0.562 . . . . 0.0 111.558 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.36 148.38 51.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -90.53 99.91 2.37 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 125.538 1.535 . . . . 0.0 113.565 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.468 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -39.98 -60.53 0.55 Allowed 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.27 3.313 . . . . 0.0 116.892 169.625 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.6 t -147.51 121.37 9.32 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.652 1.581 . . . . 0.0 108.895 170.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 C-N-CA 126.122 1.82 . . . . 0.0 110.981 -174.144 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.444 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.4 ' H3 ' ' C ' ' A' ' 33' ' ' SER . 13.6 mttp . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 117.817 -1.087 . . . . 0.0 113.757 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.421 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.28 0.0 OUTLIER -66.16 165.77 20.44 Favored Pre-proline 0 CA--C 1.569 1.692 0 CA-C-N 119.862 1.21 . . . . 0.0 113.886 -179.696 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 61.1 Cg_exo -74.99 171.96 17.29 Favored 'Trans proline' 0 CA--C 1.558 1.712 1 C-N-CA 128.294 5.996 . . . . 0.0 122.218 -175.189 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -55.5 140.52 83.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 123.818 3.012 . . . . 0.0 107.829 167.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.63 -30.55 8.06 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -169.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 98.5 m95 -78.48 144.98 35.25 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.976 1.388 . . . . 0.0 112.058 169.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 162.99 34.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.041 1.336 . . . . 0.0 111.622 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 tmpt? -74.65 131.5 40.95 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.431 0.692 . . . . 0.0 111.473 -177.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -128.27 156.09 43.56 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.298 1.439 . . . . 0.0 110.325 -173.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 14.6 ttt -135.32 143.69 46.31 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.086 0.555 . . . . 0.0 111.462 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -90.38 108.75 19.97 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 147.27 1.06 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.484 1.114 . . . . 0.0 110.918 169.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m 65.0 -5.91 0.37 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -136.15 -17.32 1.6 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.362 1.892 . . . . 0.0 114.754 169.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.16 10.15 84.19 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.788 1.185 . . . . 0.0 114.46 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 m -62.57 162.18 10.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.268 1.034 . . . . 0.0 109.68 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.9 t -128.42 149.01 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.551 1.54 . . . . 0.0 108.342 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -155.3 -163.28 1.5 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.094 2.157 . . . . 0.0 108.17 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.512 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 10.7 m-85 -134.17 151.86 51.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 109.025 177.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -134.85 132.56 38.75 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.222 1.409 . . . . 0.0 109.836 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -86.03 97.88 10.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 122.7 0.4 . . . . 0.0 110.027 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -71.7 -9.4 58.21 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 28.1 mt -84.73 -35.25 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 124.443 1.097 . . . . 0.0 111.758 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -112.56 -20.1 11.85 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 85.15 6.29 0.49 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 131.039 3.736 . . . . 0.0 114.424 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.49 165.8 16.01 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -139.61 140.71 37.06 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.613 1.565 . . . . 0.0 111.424 173.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -150.79 149.98 30.41 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.822 1.649 . . . . 0.0 107.933 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.24 -32.7 16.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.185 0.902 . . . . 0.0 111.412 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.5 145.25 56.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.084 0.857 . . . . 0.0 110.2 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.06 128.39 49.93 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 125.238 1.415 . . . . 0.0 113.123 -169.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.543 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -60.58 164.62 12.98 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.892 3.061 . . . . 0.0 114.915 169.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.4 ' C ' ' H3 ' ' A' ' 1' ' ' LYS . 86.2 p 81.84 -91.91 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 129.226 3.01 . . . . 0.0 107.945 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.328 0 C-N-CA 125.923 1.725 . . . . 0.0 114.634 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.463 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 tptp . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 117.941 -1.028 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -142.7 164.99 29.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.736 1.214 . . . . 0.0 111.355 -169.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -65.1 159.88 44.56 Favored 'Trans proline' 0 CA--C 1.547 1.163 0 C-N-CA 122.593 2.195 . . . . 0.0 113.33 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.61 117.58 4.34 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.44 2.76 . . . . 0.0 112.024 -170.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.16 -21.0 27.69 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 117.403 -1.776 . . . . 0.0 114.395 177.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -74.48 143.46 44.62 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.226 2.013 . . . . 0.0 113.866 -172.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -149.72 146.32 27.16 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.649 1.179 . . . . 0.0 110.097 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -67.81 144.72 55.22 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.517 0.675 . . . . 0.0 109.939 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -142.85 152.92 42.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.835 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.0 ttm -135.03 137.47 42.99 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.421 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 69.2 m-85 -86.22 100.77 12.47 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.893 1.277 . . . . 0.0 113.545 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.88 146.74 3.08 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.151 0.98 . . . . 0.0 110.394 169.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.2 p 73.13 -9.99 1.07 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.509 2.324 . . . . 0.0 117.036 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -136.22 -21.3 1.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 120.87 1.668 . . . . 0.0 115.239 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.96 5.91 80.15 Favored Glycine 0 CA--C 1.533 1.191 0 CA-C-N 119.312 0.96 . . . . 0.0 114.399 173.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.0 m -61.56 159.55 12.88 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.371 1.069 . . . . 0.0 109.803 172.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -134.41 144.81 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.445 1.498 . . . . 0.0 108.449 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -153.91 -166.69 2.45 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.691 2.396 . . . . 0.0 109.027 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -132.05 151.33 51.82 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.939 0.896 . . . . 0.0 109.966 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -137.39 127.57 26.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.122 1.369 . . . . 0.0 110.012 -172.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -90.78 95.29 10.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.254 0.622 . . . . 0.0 109.565 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -75.11 3.37 8.69 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.293 1.59 . . . . 0.0 115.293 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.8 mt -90.93 -29.85 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 118.864 0.756 . . . . 0.0 111.44 170.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.3 p -112.14 -23.12 10.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.84 1.256 . . . . 0.0 113.787 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 82.9 8.33 0.72 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 130.758 3.623 . . . . 0.0 113.851 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.21 163.05 21.21 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.509 1.049 . . . . 0.0 112.874 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 p -141.61 138.36 32.54 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.029 1.332 . . . . 0.0 110.255 173.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -135.04 148.4 49.89 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.138 172.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.14 -19.94 24.88 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 173.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.1 124.91 25.05 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.068 2.147 . . . . 0.0 107.694 169.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.65 124.01 85.31 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 116.984 -1.484 . . . . 0.0 109.241 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -49.34 -34.47 32.29 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 123.406 2.737 . . . . 0.0 115.211 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.6 p -159.24 29.78 0.2 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.259 1.424 . . . . 0.0 112.621 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.179 0 CA-C-O 118.249 -1.306 . . . . 0.0 113.498 -169.911 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.453 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 87.0 mttt . . . . . 0 N--CA 1.482 1.131 0 CA-C-O 116.909 -1.52 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.438 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.285 0.7 OUTLIER -72.23 165.49 50.22 Favored Pre-proline 0 CA--C 1.565 1.528 0 CA-C-N 120.21 1.368 . . . . 0.0 112.536 178.634 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.438 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 87.8 Cg_exo -66.18 162.32 36.33 Favored 'Trans proline' 0 CA--C 1.547 1.133 1 C-N-CA 126.929 5.086 . . . . 0.0 120.091 -169.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -53.62 140.43 65.67 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.597 2.864 . . . . 0.0 107.667 168.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.56 -36.84 4.03 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 117.408 -1.773 . . . . 0.0 110.297 -169.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.557 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.6 m95 -70.36 139.33 51.93 Favored 'General case' 0 C--N 1.352 0.703 0 CA-C-N 120.262 2.031 . . . . 0.0 113.255 169.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -150.2 143.48 25.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.906 1.282 . . . . 0.0 110.989 -173.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -66.2 138.94 58.04 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.516 -0.74 . . . . 0.0 111.71 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.55 154.6 47.67 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.151 1.38 . . . . 0.0 110.626 -169.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 33.8 ttp -135.11 130.25 35.18 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.844 0.858 . . . . 0.0 112.061 -173.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -76.72 97.56 4.51 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.054 1.742 . . . . 0.0 112.666 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -58.95 141.33 54.0 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 169.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 59.1 p 89.43 -14.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 129.497 3.119 . . . . 0.0 115.031 -174.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -137.42 -16.56 1.37 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.23 89.32 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.175 0.898 . . . . 0.0 114.248 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 98.9 m -64.07 160.44 18.12 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.534 1.167 . . . . 0.0 110.241 172.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 t -131.27 147.76 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 126.003 1.721 . . . . 0.0 108.775 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -157.64 -166.06 1.92 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.603 1.961 . . . . 0.0 109.03 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 5.3 m-85 -132.05 150.54 52.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.188 1.395 . . . . 0.0 108.723 175.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -137.76 128.26 26.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.705 1.202 . . . . 0.0 109.249 -172.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -86.59 96.91 10.26 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -73.92 -3.96 32.15 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mt -89.58 -33.34 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 124.514 1.126 . . . . 0.0 111.609 172.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.4 p -109.42 -20.94 12.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 85.02 5.42 0.54 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 131.44 3.896 . . . . 0.0 114.376 -172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.41 163.86 19.92 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.7 p -137.76 141.06 40.95 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.519 1.528 . . . . 0.0 111.09 171.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -148.45 147.69 29.43 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.325 1.85 . . . . 0.0 107.359 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.16 -28.78 19.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.158 0.89 . . . . 0.0 110.808 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 144.94 53.4 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.739 0.78 . . . . 0.0 109.983 169.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.67 109.07 31.83 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 126.694 1.998 . . . . 0.0 114.73 -171.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.557 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.3 OUTLIER -48.7 -28.17 12.16 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.373 2.715 . . . . 0.0 116.376 169.722 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.8 m -57.61 -23.02 48.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.658 1.583 . . . . 0.0 115.117 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.187 0 CA-C-N 119.627 1.103 . . . . 0.0 112.894 -178.681 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.443 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm . . . . . 0 N--CA 1.482 1.17 0 CA-C-O 118.325 -0.845 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.448 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.287 0.7 OUTLIER -79.68 165.56 46.89 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.859 1.263 . . . . 0.0 113.706 -169.893 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 85.9 Cg_exo -67.5 163.21 35.69 Favored 'Trans proline' 0 CA--C 1.546 1.101 1 C-N-CA 126.705 4.937 . . . . 0.0 120.309 -169.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.34 140.52 62.68 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 123.637 2.891 . . . . 0.0 107.603 168.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.58 -36.62 4.15 Favored Glycine 0 CA--C 1.526 0.72 0 CA-C-O 117.449 -1.75 . . . . 0.0 110.45 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.579 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 93.0 m95 -71.79 140.96 49.68 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 120.249 2.025 . . . . 0.0 112.975 169.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -149.37 148.38 29.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.354 1.462 . . . . 0.0 110.439 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -65.73 144.87 56.62 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.97 0.804 . . . . 0.0 111.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -145.97 153.59 40.96 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.546 0.739 . . . . 0.0 110.443 -171.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.5 ttm -130.98 132.76 45.24 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.642 0.777 . . . . 0.0 110.786 -176.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.437 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 60.0 m-85 -76.61 106.7 8.42 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.781 1.632 . . . . 0.0 113.007 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.95 146.8 13.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.578 169.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.3 p 73.82 -9.14 1.27 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.208 2.203 . . . . 0.0 116.805 -175.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.71 -20.88 0.91 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 169.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.44 4.55 80.27 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-N 119.652 1.114 . . . . 0.0 114.543 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 m -59.68 160.04 7.85 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.612 1.165 . . . . 0.0 109.899 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -129.73 147.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 125.237 1.415 . . . . 0.0 108.779 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -159.05 -168.16 2.29 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.191 1.796 . . . . 0.0 109.294 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.43 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 6.6 m-85 -129.0 149.28 50.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.699 1.199 . . . . 0.0 108.843 174.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -139.02 126.1 21.21 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.361 1.464 . . . . 0.0 109.314 -169.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -85.85 93.58 8.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -72.55 0.5 10.27 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.8 mt -89.56 -25.91 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.14 0.976 . . . . 0.0 111.428 173.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.7 p -120.09 -23.92 6.17 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.463 1.505 . . . . 0.0 114.485 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 85.08 7.41 0.45 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 131.371 3.869 . . . . 0.0 114.544 -170.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.14 15.99 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.705 1.139 . . . . 0.0 113.544 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.9 p -141.4 142.67 33.72 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.088 1.355 . . . . 0.0 111.85 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -149.65 146.54 27.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.585 1.554 . . . . 0.0 107.985 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -84.6 -28.28 26.65 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.394 0.997 . . . . 0.0 112.465 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.09 148.01 40.11 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.219 0.918 . . . . 0.0 110.617 169.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.0 126.76 56.2 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 125.053 1.341 . . . . 0.0 114.057 -169.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.579 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -64.4 -29.55 62.77 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.392 2.061 . . . . 0.0 113.869 168.705 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.0 p -69.42 81.69 0.39 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.307 1.443 . . . . 0.0 110.073 170.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 C-N-CA 126.923 2.202 . . . . 0.0 111.896 -174.388 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.442 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? . . . . . 0 N--CA 1.487 1.381 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.437 ' HB3' ' CD ' ' A' ' 3' ' ' PRO . 1.8 mp -148.56 165.97 16.7 Favored Pre-proline 0 CA--C 1.566 1.575 0 C-N-CA 129.753 3.221 . . . . 0.0 107.514 170.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.437 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 83.5 Cg_exo -60.91 165.04 12.73 Favored 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 127.931 5.754 . . . . 0.0 121.017 -171.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.82 140.35 67.82 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.506 2.804 . . . . 0.0 108.248 168.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.44 -36.8 4.06 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 118.102 -1.388 . . . . 0.0 110.253 -169.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.539 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 93.1 m95 -72.65 141.42 48.28 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 120.149 1.974 . . . . 0.0 113.889 169.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -151.04 152.61 33.72 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.987 1.315 . . . . 0.0 110.182 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 136.68 57.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.72 2.008 . . . . 0.0 112.266 -172.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.403 ' HE ' ' HB3' ' A' ' 20' ' ' PHE . 1.8 tpp180 -135.24 152.32 51.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.421 1.088 . . . . 0.0 110.348 -174.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 13.7 ttt -135.23 130.53 35.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.127 0.571 . . . . 0.0 111.701 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 67.6 m-85 -79.38 95.02 5.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.724 1.209 . . . . 0.0 113.596 -176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -58.31 141.41 51.11 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 90.45 -13.33 0.28 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 129.427 3.091 . . . . 0.0 114.954 -169.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -143.36 -21.35 0.61 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.982 1.719 . . . . 0.0 115.411 169.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.52 77.56 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 125.215 1.388 . . . . 0.0 114.754 175.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 m -59.71 162.08 5.59 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.555 1.142 . . . . 0.0 109.982 171.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.8 t -129.8 148.54 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 125.586 1.554 . . . . 0.0 108.084 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 8.1 p90 -155.97 -163.47 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.35 2.26 . . . . 0.0 108.126 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.464 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 8.9 m-85 -136.51 153.22 51.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.719 1.208 . . . . 0.0 109.388 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.403 ' HB3' ' HE ' ' A' ' 9' ' ' ARG . 77.2 t80 -140.87 127.33 19.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.722 1.209 . . . . 0.0 109.514 -170.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -79.99 98.45 7.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -69.98 -10.18 57.74 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.1 mt -87.06 -35.5 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.593 1.157 . . . . 0.0 111.729 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.3 p -110.17 -21.98 12.0 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 85.01 7.33 0.46 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 130.836 3.654 . . . . 0.0 114.091 -172.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.67 163.57 18.74 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.27 0.941 . . . . 0.0 113.35 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.5 p -135.95 144.44 45.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.283 1.433 . . . . 0.0 111.516 174.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -144.92 154.46 42.62 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.856 1.662 . . . . 0.0 107.597 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -90.1 -19.92 23.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.671 0.669 . . . . 0.0 110.099 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.61 144.47 57.19 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 169.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.88 105.14 11.1 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.27 2.228 . . . . 0.0 114.153 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.539 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -52.93 -34.98 69.12 Favored 'Trans proline' 0 C--N 1.344 0.328 0 N-CA-C 117.584 2.109 . . . . 0.0 117.584 169.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.9 m -54.38 -48.36 71.61 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.542 1.137 . . . . 0.0 113.205 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.366 -1.796 . . . . 0.0 112.508 -176.525 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.458 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.479 ' H ' ' HA ' ' A' ' 32' ' ' PRO 0.282 0.9 OUTLIER -127.9 166.01 26.53 Favored Pre-proline 0 CA--C 1.569 1.686 0 C-N-CA 125.33 1.452 . . . . 0.0 113.075 -177.32 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.431 ' CD ' ' HB3' ' A' ' 2' ' ' LEU 0.253 83.3 Cg_exo -67.47 170.73 13.02 Favored 'Trans proline' 0 CA--C 1.555 1.565 1 C-N-CA 129.359 6.706 . . . . 0.0 122.234 -173.355 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.61 140.6 83.88 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 123.773 2.982 . . . . 0.0 107.205 167.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.57 -34.86 5.14 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 109.931 -1.268 . . . . 0.0 109.931 -168.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.424 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 98.4 m95 -76.8 139.93 40.54 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 118.947 1.373 . . . . 0.0 112.51 169.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.99 142.76 30.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.383 1.473 . . . . 0.0 111.189 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -62.91 144.51 56.67 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 122.068 0.937 . . . . 0.0 111.811 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -146.65 153.37 40.23 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.022 0.929 . . . . 0.0 110.063 -169.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 35.2 ttm -133.42 129.81 37.83 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.106 0.562 . . . . 0.0 111.923 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.3 96.31 2.8 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.782 1.633 . . . . 0.0 111.478 173.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt-85 -59.75 155.58 15.7 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.046 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.1 t 65.84 -4.87 0.57 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -136.24 -20.3 1.43 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 121.376 1.898 . . . . 0.0 114.299 169.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.83 3.18 88.2 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.626 1.108 . . . . 0.0 114.157 172.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 93.2 m -65.87 158.38 28.08 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.364 1.082 . . . . 0.0 109.988 173.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.6 t -135.0 142.71 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.914 1.686 . . . . 0.0 108.269 -173.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -154.11 -166.05 2.26 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 127.156 2.182 . . . . 0.0 108.738 -172.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.418 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.9 m-85 -131.47 151.94 51.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.439 1.096 . . . . 0.0 110.394 176.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -137.97 127.27 24.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.446 1.498 . . . . 0.0 109.23 -173.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -86.55 94.38 9.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -74.02 0.6 13.14 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.93 -27.68 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.037 0.935 . . . . 0.0 111.286 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.8 p -120.06 -24.29 6.08 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.899 1.68 . . . . 0.0 114.864 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 85.22 8.33 0.4 Allowed 'General case' 0 CA--C 1.549 0.935 1 C-N-CA 131.711 4.004 . . . . 0.0 114.685 -169.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.54 167.18 13.38 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 119.815 1.189 . . . . 0.0 114.043 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.8 p -140.18 143.53 36.14 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.937 1.695 . . . . 0.0 111.318 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 155.14 43.96 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.129 1.371 . . . . 0.0 107.799 171.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.03 -19.95 23.81 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.945 175.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -71.59 151.94 43.35 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.127 1.33 . . . . 0.0 109.309 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.02 99.85 2.49 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.479 ' HA ' ' H ' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -45.29 -32.09 7.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.56 3.507 . . . . 0.0 116.686 169.159 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.5 t -132.42 19.01 4.36 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.474 0 C-N-CA 124.11 0.862 . . . . 0.0 114.638 -176.044 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.46 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.421 ' H1 ' ' C ' ' A' ' 34' ' ' GLY . 14.8 mttp . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 32' ' ' PRO . 1.3 mp -65.65 163.28 35.94 Favored Pre-proline 0 C--O 1.235 0.334 0 C-N-CA 127.009 2.124 . . . . 0.0 111.685 170.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -55.18 159.02 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 121.208 1.272 . . . . 0.0 115.015 -169.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.01 122.34 9.65 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.398 2.066 . . . . 0.0 109.357 -169.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.47 -15.61 29.69 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 115.595 -2.781 . . . . 0.0 116.789 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.508 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 60.9 m95 -68.84 131.44 45.13 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 123.215 3.508 . . . . 0.0 115.174 -174.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -152.37 148.75 27.86 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.354 1.062 . . . . 0.0 112.027 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 128.2 34.93 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.594 2.358 . . . . 0.0 112.164 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.59 156.28 46.04 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.189 1.395 . . . . 0.0 109.56 -170.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.9 ttm -135.06 142.21 46.27 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.237 0.615 . . . . 0.0 111.256 -172.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.472 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 75.1 m-85 -89.63 99.79 12.72 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.859 1.263 . . . . 0.0 113.373 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.28 147.64 2.2 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.128 0.971 . . . . 0.0 110.728 169.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.3 p 72.31 -10.5 0.9 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 127.489 2.315 . . . . 0.0 116.945 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -134.71 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.961 1.709 . . . . 0.0 114.945 169.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.67 5.94 80.91 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 119.055 0.843 . . . . 0.0 114.257 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 m -61.02 158.83 12.66 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.157 0.983 . . . . 0.0 109.682 172.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 t -132.53 148.26 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.58 1.552 . . . . 0.0 108.278 -177.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 6.8 p90 -157.4 -165.09 1.71 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.709 2.004 . . . . 0.0 108.245 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -130.84 154.07 48.43 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.522 1.129 . . . . 0.0 110.384 173.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.87 130.59 27.6 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.991 -1.459 . . . . 0.0 109.068 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -85.02 95.29 9.04 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -69.32 -0.21 5.93 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.0 mt -100.48 -27.2 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.428 1.091 . . . . 0.0 111.776 177.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -112.19 -24.45 9.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.142 1.377 . . . . 0.0 113.85 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 83.84 8.28 0.58 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 130.143 3.377 . . . . 0.0 113.707 -169.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.35 165.62 11.49 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.504 1.047 . . . . 0.0 112.741 176.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 p -139.52 154.02 47.59 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.946 1.299 . . . . 0.0 110.448 174.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -149.93 151.31 33.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.306 1.442 . . . . 0.0 107.805 169.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -87.01 -19.63 28.4 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.476 0.58 . . . . 0.0 109.724 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.22 128.5 35.87 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 168.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.89 99.85 2.45 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 -169.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.508 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -52.2 120.24 7.0 Favored 'Trans proline' 0 C--N 1.356 0.932 0 CA-C-N 122.412 1.897 . . . . 0.0 115.462 169.209 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.3 m -76.99 51.27 0.79 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.145 1.778 . . . . 0.0 112.432 172.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.421 ' C ' ' H1 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.248 1.011 0 C-N-CA 127.311 2.386 . . . . 0.0 115.303 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.472 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.26 4.0 mtmp? . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 117.009 -1.472 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.49 ' CD2' HE22 ' A' ' 28' ' ' GLN . 0.0 OUTLIER -62.77 165.47 9.67 Favored Pre-proline 0 CA--C 1.564 1.512 0 CA-C-N 120.485 1.493 . . . . 0.0 114.019 -169.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.447 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 92.1 Cg_exo -66.52 165.89 23.65 Favored 'Trans proline' 0 CA--C 1.548 1.197 1 C-N-CA 127.562 5.508 . . . . 0.0 121.392 -170.64 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.3 140.5 62.31 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 123.987 3.125 . . . . 0.0 108.062 168.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.54 -43.75 1.65 Allowed Glycine 0 CA--C 1.527 0.81 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -168.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.472 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 96.0 m95 -70.27 127.37 32.56 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.434 1.617 . . . . 0.0 111.18 169.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -147.0 150.61 35.48 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.218 1.007 . . . . 0.0 111.133 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.79 134.76 42.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.011 2.124 . . . . 0.0 112.88 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -135.77 152.78 51.46 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.202 1.401 . . . . 0.0 109.531 -178.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.7 ttt -135.17 129.74 34.27 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.018 0.527 . . . . 0.0 111.915 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.521 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 44.9 m-85 -81.03 119.04 23.02 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -169.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -55.95 150.95 12.52 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.115 -1.402 . . . . 0.0 110.365 171.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 m 67.26 -3.75 0.97 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -147.17 -21.09 0.4 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 121.751 2.069 . . . . 0.0 116.468 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.78 77.16 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 119.867 1.212 . . . . 0.0 115.169 177.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 50.6 m -54.9 158.76 2.59 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.438 1.495 . . . . 0.0 109.519 170.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.16 148.47 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 125.122 1.369 . . . . 0.0 108.931 -176.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.6 p90 -156.88 -169.51 3.0 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.577 1.551 . . . . 0.0 109.166 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -125.83 149.14 48.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 122.503 1.144 . . . . 0.0 109.054 172.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -139.0 124.38 19.28 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.829 1.652 . . . . 0.0 108.139 -172.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -75.73 99.35 4.35 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.995 174.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -68.86 -9.72 53.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.8 mt -94.09 -31.14 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.756 1.622 . . . . 0.0 112.01 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -116.5 -11.1 11.15 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 68.58 10.67 8.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.125 2.97 . . . . 0.0 115.279 -172.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.68 160.88 13.3 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.006 0.821 . . . . 0.0 112.927 170.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 p -143.44 146.21 33.26 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.925 1.29 . . . . 0.0 111.447 175.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.49 HE22 ' CD2' ' A' ' 2' ' ' LEU . 17.6 tt0 -158.2 138.7 12.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.095 1.358 . . . . 0.0 109.005 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -82.77 -19.7 37.29 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.187 -0.946 . . . . 0.0 112.114 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -77.92 142.01 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.55 110.67 42.8 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -169.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.472 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -57.53 179.15 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 124.393 3.395 . . . . 0.0 115.831 168.615 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 97.6 p 70.02 -80.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.278 2.231 . . . . 0.0 111.191 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 C-N-CA 125.727 1.632 . . . . 0.0 113.028 178.545 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.521 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 mtmm . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.462 ' HB3' ' CD ' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -73.07 165.31 53.86 Favored Pre-proline 0 CA--C 1.557 1.228 0 CA-C-N 119.685 1.13 . . . . 0.0 111.353 176.645 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.462 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 80.1 Cg_exo -60.75 159.94 26.77 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 126.559 4.84 . . . . 0.0 119.422 -169.636 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -57.17 140.58 93.2 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.17 2.58 . . . . 0.0 106.382 168.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.8 -36.41 4.25 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 116.823 -2.098 . . . . 0.0 110.161 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.568 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 88.4 m95 -69.98 135.68 49.66 Favored 'General case' 0 C--N 1.353 0.728 0 CA-C-N 121.53 2.665 . . . . 0.0 112.89 169.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -151.61 152.5 32.95 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.395 1.078 . . . . 0.0 110.542 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 135.55 57.28 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.613 1.965 . . . . 0.0 112.706 -175.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -136.93 156.75 48.06 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.955 1.302 . . . . 0.0 110.168 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.0 ttt -135.09 139.03 44.38 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.345 0.658 . . . . 0.0 111.203 -173.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.4 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 62.3 m-85 -86.52 103.01 14.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.564 1.146 . . . . 0.0 113.418 -178.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.05 134.63 52.7 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.182 169.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 t 90.19 -7.83 0.35 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.699 2.8 . . . . 0.0 115.743 -178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -141.71 -15.43 0.82 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.41 1.459 . . . . 0.0 114.224 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.73 11.19 83.35 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.383 0.992 . . . . 0.0 114.236 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 51.8 m -64.46 163.61 13.02 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.358 1.079 . . . . 0.0 110.205 170.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.2 t -130.49 149.77 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 125.707 1.603 . . . . 0.0 108.658 -175.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.5 p90 -156.26 -168.23 2.67 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.615 1.966 . . . . 0.0 109.091 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.403 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 3.8 m-85 -128.63 149.66 50.56 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.755 1.222 . . . . 0.0 108.519 173.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -139.22 126.85 21.84 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.272 1.429 . . . . 0.0 108.899 -170.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -78.92 97.63 6.09 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 123.592 0.558 . . . . 0.0 109.713 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -68.89 -7.78 37.88 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.1 mt -92.98 -33.41 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 125.355 1.462 . . . . 0.0 111.76 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.9 p -111.47 -22.31 11.34 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 85.11 6.93 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 130.913 3.685 . . . . 0.0 114.325 -172.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.05 161.78 20.91 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.519 1.054 . . . . 0.0 113.498 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.8 p -136.94 140.98 42.64 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.111 1.364 . . . . 0.0 112.08 174.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -147.15 141.62 26.46 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.114 1.766 . . . . 0.0 107.873 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -81.14 -28.54 35.03 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.507 1.049 . . . . 0.0 112.629 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.14 150.44 37.19 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.08 0.854 . . . . 0.0 110.581 169.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.26 111.31 46.33 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 127.463 2.305 . . . . 0.0 113.563 -169.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -53.73 -28.07 45.54 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.269 1.979 . . . . 0.0 116.692 169.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 63.0 p -63.99 -12.59 39.29 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.694 1.738 . . . . 0.0 115.694 -174.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.103 0 CA-C-O 118.421 -1.211 . . . . 0.0 112.948 176.696 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.419 ' HA ' ' OXT' ' A' ' 34' ' ' GLY . 13.9 tptp . . . . . 0 N--CA 1.476 0.832 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.366 2.1 mm? -62.52 165.72 8.67 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 124.62 1.168 . . . . 0.0 111.693 169.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.1 159.32 4.14 Favored 'Trans proline' 0 C--N 1.353 0.786 0 N-CA-C 118.115 2.313 . . . . 0.0 118.115 -167.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -50.09 119.1 4.49 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 123.961 3.107 . . . . 0.0 111.72 -169.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.32 -28.65 10.0 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 115.044 -3.087 . . . . 0.0 117.418 -175.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -67.67 121.32 15.66 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 124.134 3.967 . . . . 0.0 115.998 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 8' ' ' LYS . 12.0 tp10 -165.05 163.12 20.65 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.878 2.071 . . . . 0.0 110.742 169.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.6 ttpm? -49.74 145.63 5.08 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 130.55 3.54 . . . . 0.0 114.521 177.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -141.72 159.57 41.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.397 1.879 . . . . 0.0 109.031 171.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 34.4 ttp -131.94 140.34 48.98 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.338 1.055 . . . . 0.0 110.557 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.431 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 75.4 m-85 -87.27 95.9 10.15 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.829 1.252 . . . . 0.0 113.351 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.33 146.45 28.87 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 169.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.2 p 90.32 -16.82 0.21 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 130.111 3.364 . . . . 0.0 115.098 -169.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -144.23 -19.56 0.56 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.967 1.84 . . . . 0.0 115.967 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.88 6.99 71.47 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-N 119.939 1.245 . . . . 0.0 114.712 178.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -58.35 158.04 7.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 0.0 109.61 170.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.1 t -134.61 148.87 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 125.716 1.606 . . . . 0.0 108.528 -175.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.429 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 10.5 p90 -156.16 -176.47 5.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.611 1.564 . . . . 0.0 109.277 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -123.73 141.39 52.07 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.9 1.333 . . . . 0.0 108.617 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -133.59 136.63 45.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 113.518 -1.674 . . . . 0.0 108.925 -169.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -86.16 92.29 8.7 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 169.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -65.99 2.0 1.25 Allowed 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mp -105.12 -47.55 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.63 1.172 . . . . 0.0 110.969 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.7 p -85.65 -28.85 24.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.539 1.135 . . . . 0.0 113.523 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 85.02 11.97 0.27 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 130.337 3.455 . . . . 0.0 115.019 -172.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.74 19.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.29 0.95 . . . . 0.0 112.322 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.5 p -145.09 136.38 25.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.538 1.135 . . . . 0.0 111.506 176.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -135.15 159.43 41.56 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -84.44 -22.49 30.33 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.745 -1.222 . . . . 0.0 109.338 170.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.24 124.48 24.24 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.712 2.005 . . . . 0.0 109.821 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.2 126.11 57.99 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 127.211 2.204 . . . . 0.0 110.646 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -64.14 160.27 39.05 Favored 'Trans proline' 0 CA--C 1.551 1.338 0 CA-C-N 122.63 1.975 . . . . 0.0 109.858 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.4 m -74.83 58.99 0.86 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.419 ' OXT' ' HA ' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.256 1.493 0 C-N-CA 126.784 2.135 . . . . 0.0 114.241 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.431 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.583 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.449 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.25 1.7 mp -77.74 165.2 52.82 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 169.172 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.449 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 88.5 Cg_exo -60.42 159.94 25.5 Favored 'Trans proline' 0 CA--C 1.541 0.835 1 C-N-CA 126.453 4.769 . . . . 0.0 119.38 -169.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -59.59 140.57 94.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.177 2.585 . . . . 0.0 105.698 168.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.74 -35.22 4.92 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-O 116.393 -2.337 . . . . 0.0 110.514 -168.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.502 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 89.6 m95 -70.55 137.66 50.3 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-N 121.295 2.547 . . . . 0.0 112.638 169.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -146.09 141.89 28.0 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.438 1.495 . . . . 0.0 110.555 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -66.32 138.76 57.85 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 121.65 -0.656 . . . . 0.0 111.512 -174.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.67 154.29 48.61 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.279 1.432 . . . . 0.0 109.906 -169.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 22.5 ttp -134.14 137.33 44.44 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.63 0.772 . . . . 0.0 111.183 -172.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -82.27 102.14 10.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.662 1.185 . . . . 0.0 112.19 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -54.16 152.57 5.95 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.306 169.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.6 t 65.5 -4.1 0.61 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -173.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -138.87 -18.87 1.03 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.553 1.978 . . . . 0.0 114.95 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.33 6.54 89.21 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.09 0.852 . . . . 0.0 114.305 173.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.0 m -65.58 160.98 21.26 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.345 1.072 . . . . 0.0 110.197 171.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -134.3 147.31 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 125.868 1.667 . . . . 0.0 109.078 -173.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -156.61 -166.62 2.17 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.658 1.983 . . . . 0.0 108.968 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -131.44 150.92 51.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.432 1.093 . . . . 0.0 109.256 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -133.46 128.3 35.14 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 108.897 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -89.59 96.5 10.73 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.6 p80 -74.63 -1.42 21.58 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.8 mt -92.41 -34.04 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 124.571 1.148 . . . . 0.0 111.547 172.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.2 p -105.55 -21.69 13.15 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.06 6.55 0.48 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 131.407 3.883 . . . . 0.0 114.12 -172.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.99 165.13 20.78 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.5 p -140.32 138.94 35.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.632 1.573 . . . . 0.0 110.257 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -150.0 147.21 27.57 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.42 1.488 . . . . 0.0 108.38 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -90.09 -30.99 17.32 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.634 1.106 . . . . 0.0 110.666 -175.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.72 124.89 21.95 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.707 2.003 . . . . 0.0 108.227 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? -90.11 113.24 56.52 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.087 1.355 . . . . 0.0 113.188 -169.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 30.1 Cg_exo -52.92 -33.54 62.35 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 123.082 2.522 . . . . 0.0 116.993 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.423 ' HG ' ' C ' ' A' ' 32' ' ' PRO . 51.4 m -156.73 63.8 0.52 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.329 0.652 . . . . 0.0 112.187 -174.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.258 0 CA-C-O 117.965 -1.464 . . . . 0.0 113.192 173.867 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.462 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 117.446 -1.264 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.489 HD12 ' H ' ' A' ' 2' ' ' LEU 0.352 0.3 OUTLIER -66.43 165.49 23.47 Favored Pre-proline 0 CA--C 1.562 1.437 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -169.53 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 77.6 Cg_exo -74.98 167.46 27.0 Favored 'Trans proline' 0 CA--C 1.55 1.284 1 C-N-CA 127.081 5.188 . . . . 0.0 121.167 -171.445 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -54.17 140.59 71.26 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 123.827 3.018 . . . . 0.0 107.467 167.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.68 -35.86 4.57 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.977 -168.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.563 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 97.0 m95 -73.48 141.88 46.81 Favored 'General case' 0 C--N 1.348 0.535 0 CA-C-N 120.237 2.019 . . . . 0.0 112.136 169.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -150.72 154.56 37.63 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.828 1.251 . . . . 0.0 110.174 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.72 145.0 46.6 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.231 1.413 . . . . 0.0 111.861 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.5 155.29 43.01 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.18 -0.95 . . . . 0.0 110.67 -178.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.3 ttt -135.23 142.68 46.04 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.234 0.614 . . . . 0.0 111.365 -172.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.433 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 67.6 m-85 -95.29 98.12 10.36 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.572 1.149 . . . . 0.0 113.754 -177.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.3 146.62 18.78 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.901 169.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 p 90.04 -19.83 0.16 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 129.67 3.188 . . . . 0.0 114.806 -170.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -141.88 -20.31 0.73 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.48 10.27 77.34 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-N 119.385 0.993 . . . . 0.0 114.727 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.2 m -58.07 160.49 4.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.718 1.207 . . . . 0.0 109.8 170.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.67 149.86 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.575 1.55 . . . . 0.0 108.527 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -155.79 -168.09 2.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.58 1.952 . . . . 0.0 109.745 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -131.35 149.17 52.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.058 1.343 . . . . 0.0 108.961 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -137.1 127.44 26.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.073 1.749 . . . . 0.0 109.395 -171.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -80.21 99.41 7.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.133 173.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -72.03 -5.98 39.02 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.2 mt -93.61 -33.35 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.071 1.348 . . . . 0.0 111.723 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.5 p -111.29 -22.42 11.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 85.08 7.52 0.44 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.84 3.656 . . . . 0.0 114.452 -173.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.26 163.27 18.3 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 119.361 0.982 . . . . 0.0 113.568 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.6 p -144.96 137.89 26.45 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.914 1.285 . . . . 0.0 112.268 175.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.86 160.13 44.09 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.818 1.247 . . . . 0.0 109.818 169.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -87.94 -27.15 22.3 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -169.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.89 158.54 23.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.77 1.168 . . . . 0.0 111.449 172.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.0 137.31 28.19 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -170.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.563 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -70.6 -175.13 1.25 Allowed 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 124.49 3.46 . . . . 0.0 114.745 168.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.3 m 62.93 -66.99 0.09 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.842 2.057 . . . . 0.0 112.405 -171.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.297 0 C-N-CA 125.917 1.722 . . . . 0.0 112.042 173.14 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.433 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.411 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.484 ' HB3' ' CD ' ' A' ' 3' ' ' PRO 0.29 1.6 mp -142.05 165.76 25.64 Favored Pre-proline 0 CA--C 1.563 1.455 0 O-C-N 120.733 -1.23 . . . . 0.0 111.664 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.484 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 89.7 Cg_exo -60.21 163.7 14.05 Favored 'Trans proline' 0 CA--C 1.546 1.108 1 C-N-CA 127.359 5.373 . . . . 0.0 120.228 -171.197 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -57.49 140.59 93.71 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 123.3 2.667 . . . . 0.0 106.959 168.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.68 -34.88 5.12 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.545 -1.697 . . . . 0.0 109.886 -168.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.7 m95 -73.03 142.32 47.68 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.663 2.231 . . . . 0.0 112.577 169.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -148.28 153.5 38.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.264 1.426 . . . . 0.0 109.829 178.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.89 145.27 36.06 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.431 1.492 . . . . 0.0 111.608 -179.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.47 152.45 39.8 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.802 -1.186 . . . . 0.0 110.286 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.6 ttt -135.26 137.01 42.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.791 0.436 . . . . 0.0 111.929 -172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.41 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 77.1 m-85 -86.83 95.03 9.72 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 125.446 1.499 . . . . 0.0 112.869 178.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 144.24 42.25 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.2 p 89.98 -16.24 0.24 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.773 3.229 . . . . 0.0 115.061 -171.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -138.81 -20.47 1.0 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 169.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.8 7.15 78.73 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.294 1.426 . . . . 0.0 114.719 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 41.9 m -60.11 160.16 8.56 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 109.947 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.4 t -131.09 149.41 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 125.631 1.573 . . . . 0.0 107.994 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.75 -168.53 2.93 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.731 2.012 . . . . 0.0 108.577 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.463 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 7.5 m-85 -131.14 153.02 49.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 122.113 0.958 . . . . 0.0 108.779 172.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -135.08 128.56 32.45 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.757 2.023 . . . . 0.0 109.156 -172.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -84.09 100.13 10.92 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -71.92 -3.95 25.48 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.9 mt -98.17 -32.34 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 125.387 1.475 . . . . 0.0 111.831 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.7 p -113.48 -13.43 12.81 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 79.23 1.23 2.34 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 129.164 2.986 . . . . 0.0 114.147 -176.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 162.48 9.84 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -140.22 137.51 34.35 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.505 1.522 . . . . 0.0 110.978 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -145.17 144.44 30.87 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.428 1.491 . . . . 0.0 108.207 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -80.64 -19.86 44.41 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.686 -0.634 . . . . 0.0 112.329 -177.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -64.61 154.99 34.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 169.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mtp-105 -90.24 111.7 48.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 125.148 1.379 . . . . 0.0 112.706 171.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.54 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -54.32 -38.94 88.9 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 N-CA-C 116.276 1.606 . . . . 0.0 116.276 169.069 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.9 p -71.9 73.49 0.86 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.357 1.463 . . . . 0.0 111.699 175.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.373 0 C-N-CA 127.305 2.383 . . . . 0.0 112.983 176.791 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.455 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.7 m95 . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -147.42 145.77 29.35 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.453 1.501 . . . . 0.0 111.192 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -63.78 143.25 58.0 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.879 0.847 . . . . 0.0 111.52 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -144.51 151.45 39.15 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.67 1.188 . . . . 0.0 109.823 -172.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.9 ttm -135.09 130.55 35.7 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.347 0.659 . . . . 0.0 111.967 -172.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -78.31 94.96 4.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.472 1.909 . . . . 0.0 112.582 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -58.66 150.39 23.44 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 169.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 p 80.94 -14.85 0.79 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.364 2.666 . . . . 0.0 115.615 -170.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -136.58 -21.31 1.32 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.67 1.577 . . . . 0.0 115.078 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.42 3.3 72.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.686 1.136 . . . . 0.0 114.275 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -62.8 158.82 17.85 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.468 1.107 . . . . 0.0 110.124 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.4 t -131.59 147.96 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.707 1.603 . . . . 0.0 108.384 -175.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -156.58 -167.61 2.45 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.398 1.879 . . . . 0.0 109.078 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -129.44 150.46 50.78 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.069 1.348 . . . . 0.0 109.148 174.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -135.53 127.56 29.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.528 1.531 . . . . 0.0 109.062 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -86.87 97.3 10.58 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -76.16 1.31 16.1 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.8 mt -94.46 -33.82 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 124.439 1.095 . . . . 0.0 111.543 171.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.3 p -108.17 -21.11 12.92 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.1 5.68 0.52 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 131.328 3.851 . . . . 0.0 114.22 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.08 16.11 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.6 p -137.99 144.46 41.12 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.521 1.529 . . . . 0.0 109.838 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -154.31 146.68 23.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.913 1.685 . . . . 0.0 107.87 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.07 -32.08 17.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.988 0.813 . . . . 0.0 111.381 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.01 143.21 49.25 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.351 1.072 . . . . 0.0 110.196 169.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 125.8 1.64 . . . . 0.0 113.868 -169.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.5 m95 . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -145.04 145.5 31.5 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.046 1.338 . . . . 0.0 111.917 169.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -63.56 145.67 55.21 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.465 1.906 . . . . 0.0 111.98 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -141.51 151.45 43.29 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.495 1.118 . . . . 0.0 110.915 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.0 ttp -134.95 136.82 42.54 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.054 0.942 . . . . 0.0 110.812 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -86.28 104.44 15.82 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.734 1.213 . . . . 0.0 113.839 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 157.54 1.83 Allowed 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.786 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m 66.11 -10.68 0.24 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -171.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -140.8 -21.12 0.8 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 122.22 2.282 . . . . 0.0 116.309 171.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.0 7.07 78.28 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.744 1.156 . . . . 0.0 114.445 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 34.6 m -59.84 158.34 10.74 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.483 1.113 . . . . 0.0 109.502 171.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -135.08 146.88 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.269 1.428 . . . . 0.0 109.011 -174.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -156.12 -169.61 3.11 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.271 1.829 . . . . 0.0 109.541 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.47 ' CD1' ' HB2' ' A' ' 31' ' ' ARG . 1.2 m-85 -129.65 155.35 46.0 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.149 0.98 . . . . 0.0 111.308 174.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -133.32 126.79 32.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.206 1.402 . . . . 0.0 109.185 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -90.49 96.32 10.59 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.374 0.67 . . . . 0.0 109.484 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -70.04 -2.21 12.09 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.5 mt -95.05 -31.72 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 119.325 0.966 . . . . 0.0 111.224 174.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.9 p -105.43 -22.15 13.08 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.661 1.184 . . . . 0.0 113.566 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 79.91 9.16 1.47 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 130.047 3.339 . . . . 0.0 113.261 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.34 160.77 26.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.387 0.994 . . . . 0.0 111.801 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -140.19 143.03 35.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.38 1.072 . . . . 0.0 109.102 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -151.71 140.76 21.17 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.507 0.723 . . . . 0.0 109.939 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -86.82 -42.57 13.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.371 1.069 . . . . 0.0 109.469 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -79.23 87.72 4.93 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 125.412 2.53 . . . . 0.0 108.163 169.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.47 ' HB2' ' CD1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.848 0 CA-C-N 109.899 -3.319 . . . . 0.0 114.39 -171.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.9 m95 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -149.28 142.89 25.46 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.927 1.291 . . . . 0.0 111.909 -172.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -60.31 132.94 55.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.45 150.46 47.63 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.048 1.339 . . . . 0.0 109.419 -172.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.9 ttp -135.2 136.48 41.81 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.828 0.451 . . . . 0.0 112.139 -169.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 60.0 m-85 -75.6 109.5 9.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.571 1.548 . . . . 0.0 112.625 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.429 ' H ' ' NE ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -52.32 144.04 13.69 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 114.436 -1.257 . . . . 0.0 110.17 173.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.6 m 64.15 0.43 1.0 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -136.75 -25.63 1.1 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.209 1.822 . . . . 0.0 115.126 169.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.91 3.21 70.77 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 119.216 0.917 . . . . 0.0 114.906 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.3 m -56.01 156.15 5.65 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 109.357 169.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -131.89 148.14 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 C-N-CA 124.969 1.308 . . . . 0.0 108.967 -173.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.402 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.8 p90 -156.42 -170.23 3.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.41 1.884 . . . . 0.0 109.514 178.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 31' ' ' ARG . 2.9 m-85 -127.71 149.0 50.42 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.635 1.174 . . . . 0.0 108.332 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -133.98 127.92 33.33 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.163 1.385 . . . . 0.0 108.898 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -88.99 92.89 9.41 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -71.26 -0.46 9.99 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.3 mt -92.02 -24.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 124.764 1.226 . . . . 0.0 111.47 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.9 p -120.11 -22.46 6.64 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.664 1.586 . . . . 0.0 114.246 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 84.98 7.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 131.205 3.802 . . . . 0.0 114.425 -171.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.07 164.19 18.43 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 119.883 1.22 . . . . 0.0 113.666 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 p -142.49 140.69 31.95 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.297 1.439 . . . . 0.0 111.009 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -151.47 143.67 24.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.456 1.502 . . . . 0.0 108.487 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -83.35 -28.31 29.08 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.756 0.707 . . . . 0.0 112.058 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 136.58 51.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.662 0.744 . . . . 0.0 109.647 169.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.455 ' HG3' ' CE1' ' A' ' 19' ' ' TYR . 1.7 ttp-105 . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 128.227 2.611 . . . . 0.0 116.782 -169.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.7 m95 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 121.328 0.585 . . . . 0.0 112.565 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -147.78 144.65 28.37 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.063 1.345 . . . . 0.0 111.364 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -63.09 143.41 57.81 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.866 0.841 . . . . 0.0 111.56 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -147.19 156.73 43.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.028 0.931 . . . . 0.0 110.143 -170.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -134.69 145.05 48.16 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.617 0.767 . . . . 0.0 110.977 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -91.15 114.37 26.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -42.72 133.51 3.48 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.21 2.204 . . . . 0.0 111.363 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m 65.54 1.8 1.82 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -134.96 -17.58 1.87 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 120.653 1.57 . . . . 0.0 114.481 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.39 7.98 87.03 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 119.137 0.88 . . . . 0.0 114.104 173.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 88.6 m -62.42 159.39 15.55 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.439 1.119 . . . . 0.0 109.549 169.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.8 t -131.28 146.9 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 125.939 1.696 . . . . 0.0 108.267 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -159.03 -167.28 2.05 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.858 1.663 . . . . 0.0 109.425 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -129.84 151.22 50.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.868 174.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -137.37 127.67 26.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.369 1.467 . . . . 0.0 109.278 -172.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -86.74 93.71 9.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -72.78 0.77 9.97 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.0 mt -88.89 -26.72 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.188 0.995 . . . . 0.0 111.399 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.4 p -120.1 -24.14 6.1 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.741 1.616 . . . . 0.0 114.668 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 85.13 7.61 0.43 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 131.338 3.855 . . . . 0.0 114.596 -170.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.95 164.43 15.14 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.617 1.099 . . . . 0.0 113.611 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.2 p -137.63 146.94 44.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.555 1.542 . . . . 0.0 110.852 173.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -147.6 154.26 40.44 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 108.595 171.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -90.0 -19.89 23.91 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.437 0.562 . . . . 0.0 111.558 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.36 148.38 51.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 . . . . . 0 CA--C 1.544 0.736 0 C-N-CA 125.538 1.535 . . . . 0.0 113.565 -179.83 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 98.5 m95 . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 162.99 34.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.041 1.336 . . . . 0.0 111.622 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 tmpt? -74.65 131.5 40.95 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.431 0.692 . . . . 0.0 111.473 -177.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -128.27 156.09 43.56 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.298 1.439 . . . . 0.0 110.325 -173.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 14.6 ttt -135.32 143.69 46.31 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.086 0.555 . . . . 0.0 111.462 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -90.38 108.75 19.97 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 147.27 1.06 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.484 1.114 . . . . 0.0 110.918 169.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m 65.0 -5.91 0.37 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -136.15 -17.32 1.6 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.362 1.892 . . . . 0.0 114.754 169.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.16 10.15 84.19 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.788 1.185 . . . . 0.0 114.46 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 m -62.57 162.18 10.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.268 1.034 . . . . 0.0 109.68 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.9 t -128.42 149.01 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.551 1.54 . . . . 0.0 108.342 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -155.3 -163.28 1.5 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.094 2.157 . . . . 0.0 108.17 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -134.17 151.86 51.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 109.025 177.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -134.85 132.56 38.75 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.222 1.409 . . . . 0.0 109.836 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -86.03 97.88 10.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 122.7 0.4 . . . . 0.0 110.027 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -71.7 -9.4 58.21 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 28.1 mt -84.73 -35.25 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 124.443 1.097 . . . . 0.0 111.758 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -112.56 -20.1 11.85 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 85.15 6.29 0.49 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 131.039 3.736 . . . . 0.0 114.424 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.49 165.8 16.01 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -139.61 140.71 37.06 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.613 1.565 . . . . 0.0 111.424 173.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -150.79 149.98 30.41 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.822 1.649 . . . . 0.0 107.933 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.24 -32.7 16.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.185 0.902 . . . . 0.0 111.412 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.5 145.25 56.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.084 0.857 . . . . 0.0 110.2 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 C-N-CA 125.238 1.415 . . . . 0.0 113.123 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -149.72 146.32 27.16 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.649 1.179 . . . . 0.0 110.097 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -67.81 144.72 55.22 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.517 0.675 . . . . 0.0 109.939 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -142.85 152.92 42.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.835 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.0 ttm -135.03 137.47 42.99 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -86.22 100.77 12.47 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.893 1.277 . . . . 0.0 113.545 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.88 146.74 3.08 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.151 0.98 . . . . 0.0 110.394 169.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.2 p 73.13 -9.99 1.07 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.509 2.324 . . . . 0.0 117.036 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -136.22 -21.3 1.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 120.87 1.668 . . . . 0.0 115.239 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.96 5.91 80.15 Favored Glycine 0 CA--C 1.533 1.191 0 CA-C-N 119.312 0.96 . . . . 0.0 114.399 173.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.0 m -61.56 159.55 12.88 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.371 1.069 . . . . 0.0 109.803 172.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -134.41 144.81 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.445 1.498 . . . . 0.0 108.449 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -153.91 -166.69 2.45 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.691 2.396 . . . . 0.0 109.027 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -132.05 151.33 51.82 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.939 0.896 . . . . 0.0 109.966 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -137.39 127.57 26.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.122 1.369 . . . . 0.0 110.012 -172.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -90.78 95.29 10.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.254 0.622 . . . . 0.0 109.565 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -75.11 3.37 8.69 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.293 1.59 . . . . 0.0 115.293 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.8 mt -90.93 -29.85 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 118.864 0.756 . . . . 0.0 111.44 170.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.3 p -112.14 -23.12 10.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.84 1.256 . . . . 0.0 113.787 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 82.9 8.33 0.72 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 130.758 3.623 . . . . 0.0 113.851 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.21 163.05 21.21 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.509 1.049 . . . . 0.0 112.874 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 p -141.61 138.36 32.54 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.029 1.332 . . . . 0.0 110.255 173.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -135.04 148.4 49.89 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.138 172.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.14 -19.94 24.88 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 173.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.1 124.91 25.05 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.068 2.147 . . . . 0.0 107.694 169.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 116.984 -1.484 . . . . 0.0 109.241 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.6 m95 . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -150.2 143.48 25.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.906 1.282 . . . . 0.0 110.989 -173.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -66.2 138.94 58.04 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.516 -0.74 . . . . 0.0 111.71 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.55 154.6 47.67 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.151 1.38 . . . . 0.0 110.626 -169.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 33.8 ttp -135.11 130.25 35.18 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.844 0.858 . . . . 0.0 112.061 -173.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -76.72 97.56 4.51 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.054 1.742 . . . . 0.0 112.666 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -58.95 141.33 54.0 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 169.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 59.1 p 89.43 -14.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 129.497 3.119 . . . . 0.0 115.031 -174.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -137.42 -16.56 1.37 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.23 89.32 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.175 0.898 . . . . 0.0 114.248 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 98.9 m -64.07 160.44 18.12 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.534 1.167 . . . . 0.0 110.241 172.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 t -131.27 147.76 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 126.003 1.721 . . . . 0.0 108.775 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -157.64 -166.06 1.92 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.603 1.961 . . . . 0.0 109.03 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -132.05 150.54 52.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.188 1.395 . . . . 0.0 108.723 175.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -137.76 128.26 26.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.705 1.202 . . . . 0.0 109.249 -172.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -86.59 96.91 10.26 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -73.92 -3.96 32.15 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mt -89.58 -33.34 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 124.514 1.126 . . . . 0.0 111.609 172.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.4 p -109.42 -20.94 12.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 85.02 5.42 0.54 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 131.44 3.896 . . . . 0.0 114.376 -172.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.41 163.86 19.92 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.7 p -137.76 141.06 40.95 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.519 1.528 . . . . 0.0 111.09 171.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -148.45 147.69 29.43 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.325 1.85 . . . . 0.0 107.359 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.16 -28.78 19.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.158 0.89 . . . . 0.0 110.808 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 144.94 53.4 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.739 0.78 . . . . 0.0 109.983 169.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 C-N-CA 126.694 1.998 . . . . 0.0 114.73 -171.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.0 m95 . . . . . 0 N--CA 1.465 0.311 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -149.37 148.38 29.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.354 1.462 . . . . 0.0 110.439 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -65.73 144.87 56.62 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.97 0.804 . . . . 0.0 111.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -145.97 153.59 40.96 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.546 0.739 . . . . 0.0 110.443 -171.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.5 ttm -130.98 132.76 45.24 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.642 0.777 . . . . 0.0 110.786 -176.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -76.61 106.7 8.42 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.781 1.632 . . . . 0.0 113.007 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.437 ' H ' ' NE ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -53.95 146.8 13.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.578 169.893 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.3 p 73.82 -9.14 1.27 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.208 2.203 . . . . 0.0 116.805 -175.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.71 -20.88 0.91 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 169.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.44 4.55 80.27 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-N 119.652 1.114 . . . . 0.0 114.543 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 m -59.68 160.04 7.85 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.612 1.165 . . . . 0.0 109.899 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -129.73 147.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 125.237 1.415 . . . . 0.0 108.779 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -159.05 -168.16 2.29 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.191 1.796 . . . . 0.0 109.294 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -129.0 149.28 50.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.699 1.199 . . . . 0.0 108.843 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -139.02 126.1 21.21 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.361 1.464 . . . . 0.0 109.314 -169.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -85.85 93.58 8.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -72.55 0.5 10.27 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.8 mt -89.56 -25.91 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.14 0.976 . . . . 0.0 111.428 173.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.7 p -120.09 -23.92 6.17 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.463 1.505 . . . . 0.0 114.485 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 85.08 7.41 0.45 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 131.371 3.869 . . . . 0.0 114.544 -170.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.14 15.99 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.705 1.139 . . . . 0.0 113.544 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.9 p -141.4 142.67 33.72 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.088 1.355 . . . . 0.0 111.85 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -149.65 146.54 27.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.585 1.554 . . . . 0.0 107.985 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -84.6 -28.28 26.65 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.394 0.997 . . . . 0.0 112.465 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.09 148.01 40.11 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.219 0.918 . . . . 0.0 110.617 169.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.053 1.341 . . . . 0.0 114.057 -169.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . 93.1 m95 . . . . . 0 CA--C 1.537 0.453 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -151.04 152.61 33.72 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.987 1.315 . . . . 0.0 110.182 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 136.68 57.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.72 2.008 . . . . 0.0 112.266 -172.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 -135.24 152.32 51.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.421 1.088 . . . . 0.0 110.348 -174.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 13.7 ttt -135.23 130.53 35.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.127 0.571 . . . . 0.0 111.701 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 67.6 m-85 -79.38 95.02 5.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.724 1.209 . . . . 0.0 113.596 -176.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -58.31 141.41 51.11 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 90.45 -13.33 0.28 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 129.427 3.091 . . . . 0.0 114.954 -169.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -143.36 -21.35 0.61 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.982 1.719 . . . . 0.0 115.411 169.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.52 77.56 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 125.215 1.388 . . . . 0.0 114.754 175.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 m -59.71 162.08 5.59 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.555 1.142 . . . . 0.0 109.982 171.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.8 t -129.8 148.54 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 125.586 1.554 . . . . 0.0 108.084 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 8.1 p90 -155.97 -163.47 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.35 2.26 . . . . 0.0 108.126 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -136.51 153.22 51.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.719 1.208 . . . . 0.0 109.388 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -140.87 127.33 19.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.722 1.209 . . . . 0.0 109.514 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 14.8 t-20 -79.99 98.45 7.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -69.98 -10.18 57.74 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.1 mt -87.06 -35.5 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.593 1.157 . . . . 0.0 111.729 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.3 p -110.17 -21.98 12.0 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 85.01 7.33 0.46 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 130.836 3.654 . . . . 0.0 114.091 -172.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.67 163.57 18.74 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.27 0.941 . . . . 0.0 113.35 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.5 p -135.95 144.44 45.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.283 1.433 . . . . 0.0 111.516 174.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -144.92 154.46 42.62 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.856 1.662 . . . . 0.0 107.597 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -90.1 -19.92 23.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.671 0.669 . . . . 0.0 110.099 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.61 144.47 57.19 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 169.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.677 0 C-N-CA 127.27 2.228 . . . . 0.0 114.153 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 98.4 m95 . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.426 0.631 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.99 142.76 30.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.383 1.473 . . . . 0.0 111.189 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -62.91 144.51 56.67 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 122.068 0.937 . . . . 0.0 111.811 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -146.65 153.37 40.23 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.022 0.929 . . . . 0.0 110.063 -169.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 35.2 ttm -133.42 129.81 37.83 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.106 0.562 . . . . 0.0 111.923 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.3 96.31 2.8 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.782 1.633 . . . . 0.0 111.478 173.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt-85 -59.75 155.58 15.7 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.046 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.1 t 65.84 -4.87 0.57 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -136.24 -20.3 1.43 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 121.376 1.898 . . . . 0.0 114.299 169.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.83 3.18 88.2 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.626 1.108 . . . . 0.0 114.157 172.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 93.2 m -65.87 158.38 28.08 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.364 1.082 . . . . 0.0 109.988 173.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.6 t -135.0 142.71 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.914 1.686 . . . . 0.0 108.269 -173.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -154.11 -166.05 2.26 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 127.156 2.182 . . . . 0.0 108.738 -172.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -131.47 151.94 51.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.439 1.096 . . . . 0.0 110.394 176.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -137.97 127.27 24.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.446 1.498 . . . . 0.0 109.23 -173.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -86.55 94.38 9.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -74.02 0.6 13.14 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.93 -27.68 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.037 0.935 . . . . 0.0 111.286 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.8 p -120.06 -24.29 6.08 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.899 1.68 . . . . 0.0 114.864 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 85.22 8.33 0.4 Allowed 'General case' 0 CA--C 1.549 0.935 1 C-N-CA 131.711 4.004 . . . . 0.0 114.685 -169.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.54 167.18 13.38 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 119.815 1.189 . . . . 0.0 114.043 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.8 p -140.18 143.53 36.14 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.937 1.695 . . . . 0.0 111.318 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 155.14 43.96 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.129 1.371 . . . . 0.0 107.799 171.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.03 -19.95 23.81 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.945 175.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -71.59 151.94 43.35 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.127 1.33 . . . . 0.0 109.309 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.964 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.9 m95 . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -152.37 148.75 27.86 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.354 1.062 . . . . 0.0 112.027 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 128.2 34.93 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.594 2.358 . . . . 0.0 112.164 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.59 156.28 46.04 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.189 1.395 . . . . 0.0 109.56 -170.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.9 ttm -135.06 142.21 46.27 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.237 0.615 . . . . 0.0 111.256 -172.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.405 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 75.1 m-85 -89.63 99.79 12.72 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.859 1.263 . . . . 0.0 113.373 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.28 147.64 2.2 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.128 0.971 . . . . 0.0 110.728 169.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.3 p 72.31 -10.5 0.9 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 127.489 2.315 . . . . 0.0 116.945 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -134.71 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.961 1.709 . . . . 0.0 114.945 169.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.67 5.94 80.91 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 119.055 0.843 . . . . 0.0 114.257 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 m -61.02 158.83 12.66 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.157 0.983 . . . . 0.0 109.682 172.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 t -132.53 148.26 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.58 1.552 . . . . 0.0 108.278 -177.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 6.8 p90 -157.4 -165.09 1.71 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.709 2.004 . . . . 0.0 108.245 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -130.84 154.07 48.43 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.522 1.129 . . . . 0.0 110.384 173.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.87 130.59 27.6 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.991 -1.459 . . . . 0.0 109.068 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -85.02 95.29 9.04 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -69.32 -0.21 5.93 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.0 mt -100.48 -27.2 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.428 1.091 . . . . 0.0 111.776 177.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -112.19 -24.45 9.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.142 1.377 . . . . 0.0 113.85 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 83.84 8.28 0.58 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 130.143 3.377 . . . . 0.0 113.707 -169.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.35 165.62 11.49 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.504 1.047 . . . . 0.0 112.741 176.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 p -139.52 154.02 47.59 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.946 1.299 . . . . 0.0 110.448 174.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -149.93 151.31 33.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.306 1.442 . . . . 0.0 107.805 169.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -87.01 -19.63 28.4 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.476 0.58 . . . . 0.0 109.724 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.22 128.5 35.87 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 168.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 -169.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 96.0 m95 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 121.192 0.52 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -147.0 150.61 35.48 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.218 1.007 . . . . 0.0 111.133 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.79 134.76 42.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.011 2.124 . . . . 0.0 112.88 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -135.77 152.78 51.46 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.202 1.401 . . . . 0.0 109.531 -178.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.7 ttt -135.17 129.74 34.27 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.018 0.527 . . . . 0.0 111.915 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 44.9 m-85 -81.03 119.04 23.02 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -169.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -55.95 150.95 12.52 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.115 -1.402 . . . . 0.0 110.365 171.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 m 67.26 -3.75 0.97 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -147.17 -21.09 0.4 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 121.751 2.069 . . . . 0.0 116.468 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.78 77.16 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 119.867 1.212 . . . . 0.0 115.169 177.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 50.6 m -54.9 158.76 2.59 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.438 1.495 . . . . 0.0 109.519 170.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.16 148.47 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 125.122 1.369 . . . . 0.0 108.931 -176.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.6 p90 -156.88 -169.51 3.0 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.577 1.551 . . . . 0.0 109.166 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -125.83 149.14 48.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 122.503 1.144 . . . . 0.0 109.054 172.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -139.0 124.38 19.28 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.829 1.652 . . . . 0.0 108.139 -172.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -75.73 99.35 4.35 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.995 174.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -68.86 -9.72 53.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.8 mt -94.09 -31.14 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.756 1.622 . . . . 0.0 112.01 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -116.5 -11.1 11.15 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 68.58 10.67 8.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.125 2.97 . . . . 0.0 115.279 -172.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.68 160.88 13.3 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.006 0.821 . . . . 0.0 112.927 170.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 p -143.44 146.21 33.26 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.925 1.29 . . . . 0.0 111.447 175.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -158.2 138.7 12.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.095 1.358 . . . . 0.0 109.005 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -82.77 -19.7 37.29 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.187 -0.946 . . . . 0.0 112.114 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -77.92 142.01 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.905 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -169.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.4 m95 . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -151.61 152.5 32.95 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.395 1.078 . . . . 0.0 110.542 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 135.55 57.28 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.613 1.965 . . . . 0.0 112.706 -175.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -136.93 156.75 48.06 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.955 1.302 . . . . 0.0 110.168 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.0 ttt -135.09 139.03 44.38 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.345 0.658 . . . . 0.0 111.203 -173.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.4 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 62.3 m-85 -86.52 103.01 14.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.564 1.146 . . . . 0.0 113.418 -178.042 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.05 134.63 52.7 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.182 169.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 t 90.19 -7.83 0.35 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.699 2.8 . . . . 0.0 115.743 -178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -141.71 -15.43 0.82 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.41 1.459 . . . . 0.0 114.224 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.73 11.19 83.35 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.383 0.992 . . . . 0.0 114.236 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 51.8 m -64.46 163.61 13.02 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.358 1.079 . . . . 0.0 110.205 170.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.2 t -130.49 149.77 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 125.707 1.603 . . . . 0.0 108.658 -175.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.5 p90 -156.26 -168.23 2.67 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.615 1.966 . . . . 0.0 109.091 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -128.63 149.66 50.56 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.755 1.222 . . . . 0.0 108.519 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -139.22 126.85 21.84 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.272 1.429 . . . . 0.0 108.899 -170.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -78.92 97.63 6.09 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 123.592 0.558 . . . . 0.0 109.713 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -68.89 -7.78 37.88 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.1 mt -92.98 -33.41 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 125.355 1.462 . . . . 0.0 111.76 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.9 p -111.47 -22.31 11.34 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 85.11 6.93 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 130.913 3.685 . . . . 0.0 114.325 -172.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.05 161.78 20.91 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.519 1.054 . . . . 0.0 113.498 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.8 p -136.94 140.98 42.64 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.111 1.364 . . . . 0.0 112.08 174.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -147.15 141.62 26.46 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.114 1.766 . . . . 0.0 107.873 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -81.14 -28.54 35.03 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.507 1.049 . . . . 0.0 112.629 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.14 150.44 37.19 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.08 0.854 . . . . 0.0 110.581 169.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 C-N-CA 127.463 2.305 . . . . 0.0 113.563 -169.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 m95 . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 8' ' ' LYS . 12.0 tp10 -165.05 163.12 20.65 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.878 2.071 . . . . 0.0 110.742 169.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.52 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.6 ttpm? -49.74 145.63 5.08 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 130.55 3.54 . . . . 0.0 114.521 177.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -141.72 159.57 41.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.397 1.879 . . . . 0.0 109.031 171.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 34.4 ttp -131.94 140.34 48.98 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.338 1.055 . . . . 0.0 110.557 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.429 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 75.4 m-85 -87.27 95.9 10.15 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.829 1.252 . . . . 0.0 113.351 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.33 146.45 28.87 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 169.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.2 p 90.32 -16.82 0.21 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 130.111 3.364 . . . . 0.0 115.098 -169.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -144.23 -19.56 0.56 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.967 1.84 . . . . 0.0 115.967 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.88 6.99 71.47 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-N 119.939 1.245 . . . . 0.0 114.712 178.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -58.35 158.04 7.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 0.0 109.61 170.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.1 t -134.61 148.87 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 125.716 1.606 . . . . 0.0 108.528 -175.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.429 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 10.5 p90 -156.16 -176.47 5.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.611 1.564 . . . . 0.0 109.277 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -123.73 141.39 52.07 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.9 1.333 . . . . 0.0 108.617 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -133.59 136.63 45.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 113.518 -1.674 . . . . 0.0 108.925 -169.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -86.16 92.29 8.7 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 169.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -65.99 2.0 1.25 Allowed 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mp -105.12 -47.55 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.63 1.172 . . . . 0.0 110.969 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.7 p -85.65 -28.85 24.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.539 1.135 . . . . 0.0 113.523 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 85.02 11.97 0.27 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 130.337 3.455 . . . . 0.0 115.019 -172.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.74 19.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.29 0.95 . . . . 0.0 112.322 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.5 p -145.09 136.38 25.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.538 1.135 . . . . 0.0 111.506 176.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -135.15 159.43 41.56 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -84.44 -22.49 30.33 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.745 -1.222 . . . . 0.0 109.338 170.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.24 124.48 24.24 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.712 2.005 . . . . 0.0 109.821 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.625 0 C-N-CA 127.211 2.204 . . . . 0.0 110.646 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.6 m95 . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -146.09 141.89 28.0 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.438 1.495 . . . . 0.0 110.555 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -66.32 138.76 57.85 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 121.65 -0.656 . . . . 0.0 111.512 -174.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.4 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -138.67 154.29 48.61 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.279 1.432 . . . . 0.0 109.906 -169.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 22.5 ttp -134.14 137.33 44.44 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.63 0.772 . . . . 0.0 111.183 -172.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -82.27 102.14 10.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.662 1.185 . . . . 0.0 112.19 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -54.16 152.57 5.95 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.306 169.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.6 t 65.5 -4.1 0.61 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -173.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -138.87 -18.87 1.03 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.553 1.978 . . . . 0.0 114.95 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.33 6.54 89.21 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.09 0.852 . . . . 0.0 114.305 173.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.0 m -65.58 160.98 21.26 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.345 1.072 . . . . 0.0 110.197 171.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -134.3 147.31 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 125.868 1.667 . . . . 0.0 109.078 -173.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -156.61 -166.62 2.17 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.658 1.983 . . . . 0.0 108.968 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -131.44 150.92 51.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.432 1.093 . . . . 0.0 109.256 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -133.46 128.3 35.14 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 108.897 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -89.59 96.5 10.73 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.6 p80 -74.63 -1.42 21.58 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.8 mt -92.41 -34.04 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 124.571 1.148 . . . . 0.0 111.547 172.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.2 p -105.55 -21.69 13.15 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.06 6.55 0.48 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 131.407 3.883 . . . . 0.0 114.12 -172.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.99 165.13 20.78 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.5 p -140.32 138.94 35.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.632 1.573 . . . . 0.0 110.257 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -150.0 147.21 27.57 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.42 1.488 . . . . 0.0 108.38 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -90.09 -30.99 17.32 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.634 1.106 . . . . 0.0 110.666 -175.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.72 124.89 21.95 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.707 2.003 . . . . 0.0 108.227 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? . . . . . 0 CA--C 1.538 0.507 0 C-N-CA 125.087 1.355 . . . . 0.0 113.188 -169.425 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . 97.0 m95 . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -150.72 154.56 37.63 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.828 1.251 . . . . 0.0 110.174 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.72 145.0 46.6 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.231 1.413 . . . . 0.0 111.861 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.5 155.29 43.01 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.18 -0.95 . . . . 0.0 110.67 -178.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.3 ttt -135.23 142.68 46.04 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.234 0.614 . . . . 0.0 111.365 -172.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -95.29 98.12 10.36 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.572 1.149 . . . . 0.0 113.754 -177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.3 146.62 18.78 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.901 169.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 p 90.04 -19.83 0.16 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 129.67 3.188 . . . . 0.0 114.806 -170.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -141.88 -20.31 0.73 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.48 10.27 77.34 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-N 119.385 0.993 . . . . 0.0 114.727 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.2 m -58.07 160.49 4.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.718 1.207 . . . . 0.0 109.8 170.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.67 149.86 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.575 1.55 . . . . 0.0 108.527 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -155.79 -168.09 2.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.58 1.952 . . . . 0.0 109.745 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -131.35 149.17 52.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.058 1.343 . . . . 0.0 108.961 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -137.1 127.44 26.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.073 1.749 . . . . 0.0 109.395 -171.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 13.5 t-20 -80.21 99.41 7.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.133 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -72.03 -5.98 39.02 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.2 mt -93.61 -33.35 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.071 1.348 . . . . 0.0 111.723 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.5 p -111.29 -22.42 11.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 85.08 7.52 0.44 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.84 3.656 . . . . 0.0 114.452 -173.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.26 163.27 18.3 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 119.361 0.982 . . . . 0.0 113.568 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.6 p -144.96 137.89 26.45 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.914 1.285 . . . . 0.0 112.268 175.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.86 160.13 44.09 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.818 1.247 . . . . 0.0 109.818 169.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -87.94 -27.15 22.3 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -169.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.89 158.54 23.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.77 1.168 . . . . 0.0 111.449 172.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.7 m95 . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -148.28 153.5 38.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.264 1.426 . . . . 0.0 109.829 178.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.89 145.27 36.06 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.431 1.492 . . . . 0.0 111.608 -179.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.47 152.45 39.8 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.802 -1.186 . . . . 0.0 110.286 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.6 ttt -135.26 137.01 42.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.791 0.436 . . . . 0.0 111.929 -172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -86.83 95.03 9.72 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 125.446 1.499 . . . . 0.0 112.869 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 144.24 42.25 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.2 p 89.98 -16.24 0.24 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.773 3.229 . . . . 0.0 115.061 -171.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -138.81 -20.47 1.0 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 169.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.8 7.15 78.73 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.294 1.426 . . . . 0.0 114.719 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 41.9 m -60.11 160.16 8.56 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 109.947 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.4 t -131.09 149.41 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 125.631 1.573 . . . . 0.0 107.994 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.75 -168.53 2.93 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.731 2.012 . . . . 0.0 108.577 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -131.14 153.02 49.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 122.113 0.958 . . . . 0.0 108.779 172.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -135.08 128.56 32.45 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.757 2.023 . . . . 0.0 109.156 -172.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -84.09 100.13 10.92 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -71.92 -3.95 25.48 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.9 mt -98.17 -32.34 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 125.387 1.475 . . . . 0.0 111.831 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.7 p -113.48 -13.43 12.81 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 79.23 1.23 2.34 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 129.164 2.986 . . . . 0.0 114.147 -176.042 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 162.48 9.84 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -140.22 137.51 34.35 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.505 1.522 . . . . 0.0 110.978 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -145.17 144.44 30.87 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.428 1.491 . . . . 0.0 108.207 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -80.64 -19.86 44.41 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.686 -0.634 . . . . 0.0 112.329 -177.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -64.61 154.99 34.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 169.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mtp-105 . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 125.148 1.379 . . . . 0.0 112.706 171.584 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 117.362 -1.304 . . . . 0.0 108.304 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.612 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.251 0.3 OUTLIER -74.54 165.35 54.39 Favored Pre-proline 0 CA--C 1.559 1.301 0 CA-C-N 119.685 1.13 . . . . 0.0 110.142 169.714 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.496 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 73.1 Cg_exo -65.31 159.92 44.95 Favored 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.285 4.657 . . . . 0.0 119.874 -169.696 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -53.84 140.37 67.98 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.513 2.809 . . . . 0.0 107.517 168.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.55 -35.79 4.62 Favored Glycine 0 CA--C 1.524 0.611 0 CA-C-O 116.966 -2.019 . . . . 0.0 111.05 -169.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.563 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 86.7 m95 -69.56 139.33 53.72 Favored 'General case' 0 C--N 1.354 0.776 0 CA-C-N 120.707 2.254 . . . . 0.0 113.43 169.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -147.42 145.77 29.35 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.453 1.501 . . . . 0.0 111.192 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -63.78 143.25 58.0 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.879 0.847 . . . . 0.0 111.52 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -144.51 151.45 39.15 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.67 1.188 . . . . 0.0 109.823 -172.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.9 ttm -135.09 130.55 35.7 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.347 0.659 . . . . 0.0 111.967 -172.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.434 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 79.5 m-85 -78.31 94.96 4.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.472 1.909 . . . . 0.0 112.582 176.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -58.66 150.39 23.44 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 169.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 p 80.94 -14.85 0.79 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.364 2.666 . . . . 0.0 115.615 -170.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -136.58 -21.31 1.32 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.67 1.577 . . . . 0.0 115.078 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.42 3.3 72.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.686 1.136 . . . . 0.0 114.275 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -62.8 158.82 17.85 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.468 1.107 . . . . 0.0 110.124 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.4 t -131.59 147.96 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.707 1.603 . . . . 0.0 108.384 -175.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -156.58 -167.61 2.45 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.398 1.879 . . . . 0.0 109.078 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.435 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 4.7 m-85 -129.44 150.46 50.78 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.069 1.348 . . . . 0.0 109.148 174.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -135.53 127.56 29.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.528 1.531 . . . . 0.0 109.062 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -86.87 97.3 10.58 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -76.16 1.31 16.1 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.8 mt -94.46 -33.82 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 124.439 1.095 . . . . 0.0 111.543 171.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.3 p -108.17 -21.11 12.92 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.1 5.68 0.52 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 131.328 3.851 . . . . 0.0 114.22 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.08 16.11 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.6 p -137.99 144.46 41.12 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.521 1.529 . . . . 0.0 109.838 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -154.31 146.68 23.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.913 1.685 . . . . 0.0 107.87 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.07 -32.08 17.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.988 0.813 . . . . 0.0 111.381 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.01 143.21 49.25 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.351 1.072 . . . . 0.0 110.196 169.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.5 116.6 66.76 Favored Pre-proline 0 CA--C 1.538 0.49 0 C-N-CA 125.8 1.64 . . . . 0.0 113.868 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.612 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 18.6 Cg_exo -53.56 -24.93 30.79 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.796 2.997 . . . . 0.0 116.833 170.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.2 p -114.09 -82.06 0.6 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.413 1.485 . . . . 0.0 110.273 169.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.431 0 C-N-CA 124.831 1.205 . . . . 0.0 114.525 -176.771 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.434 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 mtmm . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.584 0.706 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.561 HD12 ' CE2' ' A' ' 19' ' ' TYR . 18.8 mt -148.24 177.43 1.79 Allowed Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 129.033 2.933 . . . . 0.0 107.641 -169.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -53.9 159.92 6.57 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.146 1.897 . . . . 0.0 114.409 -169.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -30.45 100.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 1 C-N-CA 125.636 4.224 . . . . 0.0 117.014 -169.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.08 -25.13 17.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 127.644 2.545 . . . . 0.0 115.77 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -72.05 129.07 37.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.077 2.439 . . . . 0.0 116.317 -169.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -145.04 145.5 31.5 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.046 1.338 . . . . 0.0 111.917 169.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -63.56 145.67 55.21 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.465 1.906 . . . . 0.0 111.98 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -141.51 151.45 43.29 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.495 1.118 . . . . 0.0 110.915 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.0 ttp -134.95 136.82 42.54 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.054 0.942 . . . . 0.0 110.812 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.493 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 68.1 m-85 -86.28 104.44 15.82 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.734 1.213 . . . . 0.0 113.839 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 157.54 1.83 Allowed 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.786 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m 66.11 -10.68 0.24 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -171.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -140.8 -21.12 0.8 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 122.22 2.282 . . . . 0.0 116.309 171.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.0 7.07 78.28 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.744 1.156 . . . . 0.0 114.445 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 34.6 m -59.84 158.34 10.74 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.483 1.113 . . . . 0.0 109.502 171.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -135.08 146.88 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.269 1.428 . . . . 0.0 109.011 -174.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -156.12 -169.61 3.11 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.271 1.829 . . . . 0.0 109.541 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.561 ' CE2' HD12 ' A' ' 2' ' ' LEU . 1.2 m-85 -129.65 155.35 46.0 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.149 0.98 . . . . 0.0 111.308 174.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -133.32 126.79 32.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.206 1.402 . . . . 0.0 109.185 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -90.49 96.32 10.59 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.374 0.67 . . . . 0.0 109.484 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -70.04 -2.21 12.09 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.5 mt -95.05 -31.72 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 119.325 0.966 . . . . 0.0 111.224 174.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.9 p -105.43 -22.15 13.08 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.661 1.184 . . . . 0.0 113.566 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 79.91 9.16 1.47 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 130.047 3.339 . . . . 0.0 113.261 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.34 160.77 26.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.387 0.994 . . . . 0.0 111.801 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -140.19 143.03 35.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.38 1.072 . . . . 0.0 109.102 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -151.71 140.76 21.17 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.507 0.723 . . . . 0.0 109.939 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -86.82 -42.57 13.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.371 1.069 . . . . 0.0 109.469 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -79.23 87.72 4.93 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 125.412 2.53 . . . . 0.0 108.163 169.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.47 ' HB2' ' CD1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -76.18 142.65 72.25 Favored Pre-proline 0 C--N 1.316 -0.848 0 CA-C-N 109.899 -3.319 . . . . 0.0 114.39 -171.326 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.495 ' HG2' HD13 ' A' ' 2' ' ' LEU . 14.9 Cg_endo -52.65 165.07 1.22 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.06 1.173 . . . . 0.0 109.974 169.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 m -55.71 72.45 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.644 2.831 . . . . 0.0 118.644 -169.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.095 0 C-N-CA 125.241 1.4 . . . . 0.0 114.917 169.911 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.493 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.473 ' HZ1' ' CD ' ' A' ' 30' ' ' GLU . 39.6 mtpt . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 116.761 -1.59 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.641 HD13 ' HG3' ' A' ' 32' ' ' PRO 0.284 0.4 OUTLIER -138.89 161.58 57.36 Favored Pre-proline 0 CA--C 1.556 1.18 0 CA-C-N 120.392 1.451 . . . . 0.0 112.948 178.193 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.471 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 76.7 Cg_exo -66.98 160.57 46.54 Favored 'Trans proline' 0 CA--C 1.543 0.954 1 C-N-CA 126.49 4.794 . . . . 0.0 120.44 -169.468 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -58.24 140.64 95.07 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.133 2.555 . . . . 0.0 105.805 168.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.83 -32.57 6.47 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 116.59 -2.228 . . . . 0.0 110.76 -168.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.557 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.9 m95 -71.76 137.96 48.07 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 121.215 2.508 . . . . 0.0 112.665 169.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -149.28 142.89 25.46 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.927 1.291 . . . . 0.0 111.909 -172.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -60.31 132.94 55.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.45 150.46 47.63 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.048 1.339 . . . . 0.0 109.419 -172.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.9 ttp -135.2 136.48 41.81 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.828 0.451 . . . . 0.0 112.139 -169.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 60.0 m-85 -75.6 109.5 9.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.571 1.548 . . . . 0.0 112.625 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.429 ' H ' ' NE ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -52.32 144.04 13.69 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 114.436 -1.257 . . . . 0.0 110.17 173.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.6 m 64.15 0.43 1.0 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -136.75 -25.63 1.1 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.209 1.822 . . . . 0.0 115.126 169.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.91 3.21 70.77 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 119.216 0.917 . . . . 0.0 114.906 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.3 m -56.01 156.15 5.65 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 109.357 169.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -131.89 148.14 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 C-N-CA 124.969 1.308 . . . . 0.0 108.967 -173.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.402 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.8 p90 -156.42 -170.23 3.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.41 1.884 . . . . 0.0 109.514 178.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 31' ' ' ARG . 2.9 m-85 -127.71 149.0 50.42 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.635 1.174 . . . . 0.0 108.332 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -133.98 127.92 33.33 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.163 1.385 . . . . 0.0 108.898 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -88.99 92.89 9.41 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -71.26 -0.46 9.99 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.3 mt -92.02 -24.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 124.764 1.226 . . . . 0.0 111.47 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.9 p -120.11 -22.46 6.64 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.664 1.586 . . . . 0.0 114.246 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 84.98 7.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 131.205 3.802 . . . . 0.0 114.425 -171.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.07 164.19 18.43 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 119.883 1.22 . . . . 0.0 113.666 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 p -142.49 140.69 31.95 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.297 1.439 . . . . 0.0 111.009 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -151.47 143.67 24.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.456 1.502 . . . . 0.0 108.487 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -83.35 -28.31 29.08 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.756 0.707 . . . . 0.0 112.058 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.473 ' CD ' ' HZ1' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -69.37 136.58 51.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.662 0.744 . . . . 0.0 109.647 169.757 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.455 ' HG3' ' CE1' ' A' ' 19' ' ' TYR . 1.7 ttp-105 -90.3 110.77 43.05 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 128.227 2.611 . . . . 0.0 116.782 -169.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.641 ' HG3' HD13 ' A' ' 2' ' ' LEU . 74.8 Cg_exo -61.0 171.06 4.1 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.401 2.067 . . . . 0.0 112.195 169.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.4 p 175.19 72.72 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 172.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.409 ' C ' ' H3 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 CA--C 1.533 1.192 0 N-CA-C 107.065 -2.414 . . . . 0.0 107.065 -168.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.794 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 0.7 OUTLIER -139.73 165.83 28.36 Favored Pre-proline 0 CA--C 1.566 1.567 0 C-N-CA 127.229 2.212 . . . . 0.0 108.838 174.406 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.564 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 93.8 Cg_exo -63.1 166.12 15.24 Favored 'Trans proline' 0 CA--C 1.551 1.36 1 C-N-CA 128.142 5.895 . . . . 0.0 121.586 -172.749 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -55.0 140.43 79.87 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 123.496 2.798 . . . . 0.0 107.463 168.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.5 -33.79 5.75 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.419 -1.212 . . . . 0.0 110.185 -169.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.437 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 97.7 m95 -76.5 140.61 41.26 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 118.999 1.399 . . . . 0.0 112.565 169.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -147.78 144.65 28.37 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.063 1.345 . . . . 0.0 111.364 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -63.09 143.41 57.81 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.866 0.841 . . . . 0.0 111.56 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -147.19 156.73 43.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.028 0.931 . . . . 0.0 110.143 -170.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -134.69 145.05 48.16 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.617 0.767 . . . . 0.0 110.977 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.458 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 57.0 m-85 -91.15 114.37 26.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -42.72 133.51 3.48 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.21 2.204 . . . . 0.0 111.363 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m 65.54 1.8 1.82 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -134.96 -17.58 1.87 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 120.653 1.57 . . . . 0.0 114.481 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.39 7.98 87.03 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 119.137 0.88 . . . . 0.0 114.104 173.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 88.6 m -62.42 159.39 15.55 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.439 1.119 . . . . 0.0 109.549 169.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.8 t -131.28 146.9 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 125.939 1.696 . . . . 0.0 108.267 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -159.03 -167.28 2.05 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.858 1.663 . . . . 0.0 109.425 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.426 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.3 m-85 -129.84 151.22 50.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.868 174.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -137.37 127.67 26.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.369 1.467 . . . . 0.0 109.278 -172.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -86.74 93.71 9.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -72.78 0.77 9.97 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.0 mt -88.89 -26.72 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.188 0.995 . . . . 0.0 111.399 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.4 p -120.1 -24.14 6.1 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.741 1.616 . . . . 0.0 114.668 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 85.13 7.61 0.43 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 131.338 3.855 . . . . 0.0 114.596 -170.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.95 164.43 15.14 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.617 1.099 . . . . 0.0 113.611 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.2 p -137.63 146.94 44.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.555 1.542 . . . . 0.0 110.852 173.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -147.6 154.26 40.44 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 108.595 171.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -90.0 -19.89 23.91 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.437 0.562 . . . . 0.0 111.558 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.36 148.38 51.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -90.53 99.91 2.37 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 125.538 1.535 . . . . 0.0 113.565 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.794 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -39.98 -60.53 0.55 Allowed 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.27 3.313 . . . . 0.0 116.892 169.625 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.6 t -147.51 121.37 9.32 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.652 1.581 . . . . 0.0 108.895 170.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 C-N-CA 126.122 1.82 . . . . 0.0 110.981 -174.144 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.458 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.6 mttp . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 117.817 -1.087 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.728 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.28 0.0 OUTLIER -66.16 165.77 20.44 Favored Pre-proline 0 CA--C 1.569 1.692 0 CA-C-N 119.862 1.21 . . . . 0.0 113.886 -179.696 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.481 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 61.1 Cg_exo -74.99 171.96 17.29 Favored 'Trans proline' 0 CA--C 1.558 1.712 1 C-N-CA 128.294 5.996 . . . . 0.0 122.218 -175.189 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -55.5 140.52 83.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 123.818 3.012 . . . . 0.0 107.829 167.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.63 -30.55 8.06 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -169.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.535 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 98.5 m95 -78.48 144.98 35.25 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.976 1.388 . . . . 0.0 112.058 169.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 162.99 34.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.041 1.336 . . . . 0.0 111.622 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 tmpt? -74.65 131.5 40.95 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.431 0.692 . . . . 0.0 111.473 -177.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -128.27 156.09 43.56 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.298 1.439 . . . . 0.0 110.325 -173.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 14.6 ttt -135.32 143.69 46.31 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.086 0.555 . . . . 0.0 111.462 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -90.38 108.75 19.97 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 147.27 1.06 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.484 1.114 . . . . 0.0 110.918 169.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m 65.0 -5.91 0.37 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -136.15 -17.32 1.6 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.362 1.892 . . . . 0.0 114.754 169.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.16 10.15 84.19 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.788 1.185 . . . . 0.0 114.46 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 m -62.57 162.18 10.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.268 1.034 . . . . 0.0 109.68 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.9 t -128.42 149.01 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.551 1.54 . . . . 0.0 108.342 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -155.3 -163.28 1.5 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.094 2.157 . . . . 0.0 108.17 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.545 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 10.7 m-85 -134.17 151.86 51.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 109.025 177.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -134.85 132.56 38.75 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.222 1.409 . . . . 0.0 109.836 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -86.03 97.88 10.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 122.7 0.4 . . . . 0.0 110.027 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -71.7 -9.4 58.21 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 28.1 mt -84.73 -35.25 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 124.443 1.097 . . . . 0.0 111.758 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -112.56 -20.1 11.85 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 85.15 6.29 0.49 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 131.039 3.736 . . . . 0.0 114.424 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.49 165.8 16.01 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -139.61 140.71 37.06 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.613 1.565 . . . . 0.0 111.424 173.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -150.79 149.98 30.41 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.822 1.649 . . . . 0.0 107.933 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.24 -32.7 16.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.185 0.902 . . . . 0.0 111.412 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.5 145.25 56.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.084 0.857 . . . . 0.0 110.2 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.06 128.39 49.93 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 125.238 1.415 . . . . 0.0 113.123 -169.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.728 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.1 OUTLIER -60.58 164.62 12.98 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.892 3.061 . . . . 0.0 114.915 169.61 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 86.2 p 81.84 -91.91 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 129.226 3.01 . . . . 0.0 107.945 -169.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.328 0 C-N-CA 125.923 1.725 . . . . 0.0 114.634 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 tptp . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 117.941 -1.028 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -142.7 164.99 29.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.736 1.214 . . . . 0.0 111.355 -169.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -65.1 159.88 44.56 Favored 'Trans proline' 0 CA--C 1.547 1.163 0 C-N-CA 122.593 2.195 . . . . 0.0 113.33 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.61 117.58 4.34 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.44 2.76 . . . . 0.0 112.024 -170.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.16 -21.0 27.69 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 117.403 -1.776 . . . . 0.0 114.395 177.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -74.48 143.46 44.62 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.226 2.013 . . . . 0.0 113.866 -172.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -149.72 146.32 27.16 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.649 1.179 . . . . 0.0 110.097 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -67.81 144.72 55.22 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.517 0.675 . . . . 0.0 109.939 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -142.85 152.92 42.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.835 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.0 ttm -135.03 137.47 42.99 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.434 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 69.2 m-85 -86.22 100.77 12.47 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.893 1.277 . . . . 0.0 113.545 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.88 146.74 3.08 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.151 0.98 . . . . 0.0 110.394 169.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.2 p 73.13 -9.99 1.07 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.509 2.324 . . . . 0.0 117.036 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -136.22 -21.3 1.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 120.87 1.668 . . . . 0.0 115.239 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.96 5.91 80.15 Favored Glycine 0 CA--C 1.533 1.191 0 CA-C-N 119.312 0.96 . . . . 0.0 114.399 173.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.0 m -61.56 159.55 12.88 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.371 1.069 . . . . 0.0 109.803 172.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -134.41 144.81 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.445 1.498 . . . . 0.0 108.449 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -153.91 -166.69 2.45 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.691 2.396 . . . . 0.0 109.027 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -132.05 151.33 51.82 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.939 0.896 . . . . 0.0 109.966 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -137.39 127.57 26.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.122 1.369 . . . . 0.0 110.012 -172.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -90.78 95.29 10.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.254 0.622 . . . . 0.0 109.565 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -75.11 3.37 8.69 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.293 1.59 . . . . 0.0 115.293 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.8 mt -90.93 -29.85 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 118.864 0.756 . . . . 0.0 111.44 170.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.3 p -112.14 -23.12 10.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.84 1.256 . . . . 0.0 113.787 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 82.9 8.33 0.72 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 130.758 3.623 . . . . 0.0 113.851 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.21 163.05 21.21 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.509 1.049 . . . . 0.0 112.874 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 p -141.61 138.36 32.54 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.029 1.332 . . . . 0.0 110.255 173.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -135.04 148.4 49.89 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.138 172.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.14 -19.94 24.88 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 173.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.1 124.91 25.05 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.068 2.147 . . . . 0.0 107.694 169.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.65 124.01 85.31 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 116.984 -1.484 . . . . 0.0 109.241 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -49.34 -34.47 32.29 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 123.406 2.737 . . . . 0.0 115.211 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.6 p -159.24 29.78 0.2 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.259 1.424 . . . . 0.0 112.621 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.179 0 CA-C-O 118.249 -1.306 . . . . 0.0 113.498 -169.911 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.434 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 87.0 mttt . . . . . 0 N--CA 1.482 1.131 0 CA-C-O 116.909 -1.52 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.671 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.285 0.7 OUTLIER -72.23 165.49 50.22 Favored Pre-proline 0 CA--C 1.565 1.528 0 CA-C-N 120.21 1.368 . . . . 0.0 112.536 178.634 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 87.8 Cg_exo -66.18 162.32 36.33 Favored 'Trans proline' 0 CA--C 1.547 1.133 1 C-N-CA 126.929 5.086 . . . . 0.0 120.091 -169.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -53.62 140.43 65.67 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.597 2.864 . . . . 0.0 107.667 168.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.56 -36.84 4.03 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 117.408 -1.773 . . . . 0.0 110.297 -169.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.552 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.6 m95 -70.36 139.33 51.93 Favored 'General case' 0 C--N 1.352 0.703 0 CA-C-N 120.262 2.031 . . . . 0.0 113.255 169.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -150.2 143.48 25.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.906 1.282 . . . . 0.0 110.989 -173.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -66.2 138.94 58.04 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.516 -0.74 . . . . 0.0 111.71 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.55 154.6 47.67 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.151 1.38 . . . . 0.0 110.626 -169.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 33.8 ttp -135.11 130.25 35.18 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.844 0.858 . . . . 0.0 112.061 -173.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -76.72 97.56 4.51 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.054 1.742 . . . . 0.0 112.666 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -58.95 141.33 54.0 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 169.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 59.1 p 89.43 -14.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 129.497 3.119 . . . . 0.0 115.031 -174.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -137.42 -16.56 1.37 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.23 89.32 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.175 0.898 . . . . 0.0 114.248 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 98.9 m -64.07 160.44 18.12 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.534 1.167 . . . . 0.0 110.241 172.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 t -131.27 147.76 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 126.003 1.721 . . . . 0.0 108.775 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -157.64 -166.06 1.92 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.603 1.961 . . . . 0.0 109.03 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.438 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 5.3 m-85 -132.05 150.54 52.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.188 1.395 . . . . 0.0 108.723 175.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -137.76 128.26 26.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.705 1.202 . . . . 0.0 109.249 -172.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -86.59 96.91 10.26 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -73.92 -3.96 32.15 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mt -89.58 -33.34 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 124.514 1.126 . . . . 0.0 111.609 172.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.4 p -109.42 -20.94 12.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 85.02 5.42 0.54 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 131.44 3.896 . . . . 0.0 114.376 -172.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.41 163.86 19.92 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.7 p -137.76 141.06 40.95 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.519 1.528 . . . . 0.0 111.09 171.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -148.45 147.69 29.43 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.325 1.85 . . . . 0.0 107.359 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.16 -28.78 19.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.158 0.89 . . . . 0.0 110.808 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 144.94 53.4 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.739 0.78 . . . . 0.0 109.983 169.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.67 109.07 31.83 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 126.694 1.998 . . . . 0.0 114.73 -171.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.671 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.3 OUTLIER -48.7 -28.17 12.16 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.373 2.715 . . . . 0.0 116.376 169.722 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.8 m -57.61 -23.02 48.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.658 1.583 . . . . 0.0 115.117 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.187 0 CA-C-N 119.627 1.103 . . . . 0.0 112.894 -178.681 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm . . . . . 0 N--CA 1.482 1.17 0 CA-C-O 118.325 -0.845 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.611 HD13 ' HG3' ' A' ' 32' ' ' PRO 0.287 0.7 OUTLIER -79.68 165.56 46.89 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.859 1.263 . . . . 0.0 113.706 -169.893 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.52 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 85.9 Cg_exo -67.5 163.21 35.69 Favored 'Trans proline' 0 CA--C 1.546 1.101 1 C-N-CA 126.705 4.937 . . . . 0.0 120.309 -169.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.34 140.52 62.68 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 123.637 2.891 . . . . 0.0 107.603 168.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.58 -36.62 4.15 Favored Glycine 0 CA--C 1.526 0.72 0 CA-C-O 117.449 -1.75 . . . . 0.0 110.45 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.584 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 93.0 m95 -71.79 140.96 49.68 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 120.249 2.025 . . . . 0.0 112.975 169.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -149.37 148.38 29.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.354 1.462 . . . . 0.0 110.439 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -65.73 144.87 56.62 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.97 0.804 . . . . 0.0 111.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -145.97 153.59 40.96 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.546 0.739 . . . . 0.0 110.443 -171.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.5 ttm -130.98 132.76 45.24 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.642 0.777 . . . . 0.0 110.786 -176.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.458 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 60.0 m-85 -76.61 106.7 8.42 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.781 1.632 . . . . 0.0 113.007 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.437 ' H ' ' NE ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -53.95 146.8 13.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.578 169.893 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.3 p 73.82 -9.14 1.27 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.208 2.203 . . . . 0.0 116.805 -175.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.71 -20.88 0.91 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 169.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.44 4.55 80.27 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-N 119.652 1.114 . . . . 0.0 114.543 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 m -59.68 160.04 7.85 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.612 1.165 . . . . 0.0 109.899 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -129.73 147.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 125.237 1.415 . . . . 0.0 108.779 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -159.05 -168.16 2.29 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.191 1.796 . . . . 0.0 109.294 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.453 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 6.6 m-85 -129.0 149.28 50.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.699 1.199 . . . . 0.0 108.843 174.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -139.02 126.1 21.21 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.361 1.464 . . . . 0.0 109.314 -169.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -85.85 93.58 8.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -72.55 0.5 10.27 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.8 mt -89.56 -25.91 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.14 0.976 . . . . 0.0 111.428 173.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.7 p -120.09 -23.92 6.17 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.463 1.505 . . . . 0.0 114.485 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 85.08 7.41 0.45 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 131.371 3.869 . . . . 0.0 114.544 -170.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.14 15.99 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.705 1.139 . . . . 0.0 113.544 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.9 p -141.4 142.67 33.72 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.088 1.355 . . . . 0.0 111.85 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -149.65 146.54 27.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.585 1.554 . . . . 0.0 107.985 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -84.6 -28.28 26.65 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.394 0.997 . . . . 0.0 112.465 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.09 148.01 40.11 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.219 0.918 . . . . 0.0 110.617 169.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.0 126.76 56.2 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 125.053 1.341 . . . . 0.0 114.057 -169.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HG3' HD13 ' A' ' 2' ' ' LEU . 0.2 OUTLIER -64.4 -29.55 62.77 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.392 2.061 . . . . 0.0 113.869 168.705 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.0 p -69.42 81.69 0.39 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.307 1.443 . . . . 0.0 110.073 170.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 C-N-CA 126.923 2.202 . . . . 0.0 111.896 -174.388 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.458 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? . . . . . 0 N--CA 1.487 1.381 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.734 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 1.8 mp -148.56 165.97 16.7 Favored Pre-proline 0 CA--C 1.566 1.575 0 C-N-CA 129.753 3.221 . . . . 0.0 107.514 170.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.491 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 83.5 Cg_exo -60.91 165.04 12.73 Favored 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 127.931 5.754 . . . . 0.0 121.017 -171.548 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.82 140.35 67.82 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.506 2.804 . . . . 0.0 108.248 168.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.44 -36.8 4.06 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 118.102 -1.388 . . . . 0.0 110.253 -169.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.545 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 93.1 m95 -72.65 141.42 48.28 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 120.149 1.974 . . . . 0.0 113.889 169.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -151.04 152.61 33.72 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.987 1.315 . . . . 0.0 110.182 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 136.68 57.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.72 2.008 . . . . 0.0 112.266 -172.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 -135.24 152.32 51.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.421 1.088 . . . . 0.0 110.348 -174.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 13.7 ttt -135.23 130.53 35.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.127 0.571 . . . . 0.0 111.701 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 67.6 m-85 -79.38 95.02 5.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.724 1.209 . . . . 0.0 113.596 -176.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -58.31 141.41 51.11 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 90.45 -13.33 0.28 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 129.427 3.091 . . . . 0.0 114.954 -169.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -143.36 -21.35 0.61 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.982 1.719 . . . . 0.0 115.411 169.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.52 77.56 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 125.215 1.388 . . . . 0.0 114.754 175.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 m -59.71 162.08 5.59 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.555 1.142 . . . . 0.0 109.982 171.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.8 t -129.8 148.54 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 125.586 1.554 . . . . 0.0 108.084 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 8.1 p90 -155.97 -163.47 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.35 2.26 . . . . 0.0 108.126 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.472 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 8.9 m-85 -136.51 153.22 51.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.719 1.208 . . . . 0.0 109.388 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -140.87 127.33 19.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.722 1.209 . . . . 0.0 109.514 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 14.8 t-20 -79.99 98.45 7.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -69.98 -10.18 57.74 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.1 mt -87.06 -35.5 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.593 1.157 . . . . 0.0 111.729 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.3 p -110.17 -21.98 12.0 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 85.01 7.33 0.46 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 130.836 3.654 . . . . 0.0 114.091 -172.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.67 163.57 18.74 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.27 0.941 . . . . 0.0 113.35 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.5 p -135.95 144.44 45.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.283 1.433 . . . . 0.0 111.516 174.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -144.92 154.46 42.62 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.856 1.662 . . . . 0.0 107.597 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -90.1 -19.92 23.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.671 0.669 . . . . 0.0 110.099 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.61 144.47 57.19 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 169.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.88 105.14 11.1 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.27 2.228 . . . . 0.0 114.153 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.734 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.1 OUTLIER -52.93 -34.98 69.12 Favored 'Trans proline' 0 C--N 1.344 0.328 0 N-CA-C 117.584 2.109 . . . . 0.0 117.584 169.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.9 m -54.38 -48.36 71.61 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.542 1.137 . . . . 0.0 113.205 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.366 -1.796 . . . . 0.0 112.508 -176.525 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.583 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.282 0.9 OUTLIER -127.9 166.01 26.53 Favored Pre-proline 0 CA--C 1.569 1.686 0 C-N-CA 125.33 1.452 . . . . 0.0 113.075 -177.32 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.49 ' CD ' ' HB3' ' A' ' 2' ' ' LEU 0.253 83.3 Cg_exo -67.47 170.73 13.02 Favored 'Trans proline' 0 CA--C 1.555 1.565 1 C-N-CA 129.359 6.706 . . . . 0.0 122.234 -173.355 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.61 140.6 83.88 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 123.773 2.982 . . . . 0.0 107.205 167.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.57 -34.86 5.14 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 109.931 -1.268 . . . . 0.0 109.931 -168.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.407 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 98.4 m95 -76.8 139.93 40.54 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 118.947 1.373 . . . . 0.0 112.51 169.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.99 142.76 30.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.383 1.473 . . . . 0.0 111.189 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -62.91 144.51 56.67 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 122.068 0.937 . . . . 0.0 111.811 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -146.65 153.37 40.23 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.022 0.929 . . . . 0.0 110.063 -169.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 35.2 ttm -133.42 129.81 37.83 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.106 0.562 . . . . 0.0 111.923 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.3 96.31 2.8 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.782 1.633 . . . . 0.0 111.478 173.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt-85 -59.75 155.58 15.7 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.046 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.1 t 65.84 -4.87 0.57 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -136.24 -20.3 1.43 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 121.376 1.898 . . . . 0.0 114.299 169.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.83 3.18 88.2 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.626 1.108 . . . . 0.0 114.157 172.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 93.2 m -65.87 158.38 28.08 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.364 1.082 . . . . 0.0 109.988 173.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.6 t -135.0 142.71 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.914 1.686 . . . . 0.0 108.269 -173.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -154.11 -166.05 2.26 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 127.156 2.182 . . . . 0.0 108.738 -172.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.9 m-85 -131.47 151.94 51.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.439 1.096 . . . . 0.0 110.394 176.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -137.97 127.27 24.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.446 1.498 . . . . 0.0 109.23 -173.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -86.55 94.38 9.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -74.02 0.6 13.14 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.93 -27.68 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.037 0.935 . . . . 0.0 111.286 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.8 p -120.06 -24.29 6.08 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.899 1.68 . . . . 0.0 114.864 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 85.22 8.33 0.4 Allowed 'General case' 0 CA--C 1.549 0.935 1 C-N-CA 131.711 4.004 . . . . 0.0 114.685 -169.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.54 167.18 13.38 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 119.815 1.189 . . . . 0.0 114.043 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.8 p -140.18 143.53 36.14 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.937 1.695 . . . . 0.0 111.318 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 155.14 43.96 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.129 1.371 . . . . 0.0 107.799 171.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.03 -19.95 23.81 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.945 175.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -71.59 151.94 43.35 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.127 1.33 . . . . 0.0 109.309 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.02 99.85 2.49 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.583 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -45.29 -32.09 7.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.56 3.507 . . . . 0.0 116.686 169.159 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.5 t -132.42 19.01 4.36 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.474 0 C-N-CA 124.11 0.862 . . . . 0.0 114.638 -176.044 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.8 mttp . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.448 ' CB ' ' HB3' ' A' ' 32' ' ' PRO . 1.3 mp -65.65 163.28 35.94 Favored Pre-proline 0 C--O 1.235 0.334 0 C-N-CA 127.009 2.124 . . . . 0.0 111.685 170.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -55.18 159.02 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 121.208 1.272 . . . . 0.0 115.015 -169.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.01 122.34 9.65 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.398 2.066 . . . . 0.0 109.357 -169.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.47 -15.61 29.69 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 115.595 -2.781 . . . . 0.0 116.789 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.488 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 60.9 m95 -68.84 131.44 45.13 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 123.215 3.508 . . . . 0.0 115.174 -174.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -152.37 148.75 27.86 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.354 1.062 . . . . 0.0 112.027 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 128.2 34.93 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.594 2.358 . . . . 0.0 112.164 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.59 156.28 46.04 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.189 1.395 . . . . 0.0 109.56 -170.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.9 ttm -135.06 142.21 46.27 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.237 0.615 . . . . 0.0 111.256 -172.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.495 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 75.1 m-85 -89.63 99.79 12.72 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.859 1.263 . . . . 0.0 113.373 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.28 147.64 2.2 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.128 0.971 . . . . 0.0 110.728 169.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.3 p 72.31 -10.5 0.9 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 127.489 2.315 . . . . 0.0 116.945 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -134.71 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.961 1.709 . . . . 0.0 114.945 169.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.67 5.94 80.91 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 119.055 0.843 . . . . 0.0 114.257 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 m -61.02 158.83 12.66 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.157 0.983 . . . . 0.0 109.682 172.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 t -132.53 148.26 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.58 1.552 . . . . 0.0 108.278 -177.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 6.8 p90 -157.4 -165.09 1.71 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.709 2.004 . . . . 0.0 108.245 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -130.84 154.07 48.43 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.522 1.129 . . . . 0.0 110.384 173.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.87 130.59 27.6 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.991 -1.459 . . . . 0.0 109.068 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -85.02 95.29 9.04 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -69.32 -0.21 5.93 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.0 mt -100.48 -27.2 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.428 1.091 . . . . 0.0 111.776 177.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -112.19 -24.45 9.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.142 1.377 . . . . 0.0 113.85 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 83.84 8.28 0.58 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 130.143 3.377 . . . . 0.0 113.707 -169.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.35 165.62 11.49 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.504 1.047 . . . . 0.0 112.741 176.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 p -139.52 154.02 47.59 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.946 1.299 . . . . 0.0 110.448 174.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -149.93 151.31 33.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.306 1.442 . . . . 0.0 107.805 169.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -87.01 -19.63 28.4 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.476 0.58 . . . . 0.0 109.724 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.22 128.5 35.87 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 168.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.89 99.85 2.45 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 -169.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.488 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -52.2 120.24 7.0 Favored 'Trans proline' 0 C--N 1.356 0.932 0 CA-C-N 122.412 1.897 . . . . 0.0 115.462 169.209 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.3 m -76.99 51.27 0.79 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.145 1.778 . . . . 0.0 112.432 172.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 C-N-CA 127.311 2.386 . . . . 0.0 115.303 177.727 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.495 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.26 4.0 mtmp? . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 117.009 -1.472 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.685 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -62.77 165.47 9.67 Favored Pre-proline 0 CA--C 1.564 1.512 0 CA-C-N 120.485 1.493 . . . . 0.0 114.019 -169.872 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.527 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 92.1 Cg_exo -66.52 165.89 23.65 Favored 'Trans proline' 0 CA--C 1.548 1.197 1 C-N-CA 127.562 5.508 . . . . 0.0 121.392 -170.64 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.3 140.5 62.31 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 123.987 3.125 . . . . 0.0 108.062 168.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.54 -43.75 1.65 Allowed Glycine 0 CA--C 1.527 0.81 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -168.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.479 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 96.0 m95 -70.27 127.37 32.56 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.434 1.617 . . . . 0.0 111.18 169.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -147.0 150.61 35.48 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.218 1.007 . . . . 0.0 111.133 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.79 134.76 42.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.011 2.124 . . . . 0.0 112.88 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -135.77 152.78 51.46 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.202 1.401 . . . . 0.0 109.531 -178.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.7 ttt -135.17 129.74 34.27 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.018 0.527 . . . . 0.0 111.915 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.579 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 44.9 m-85 -81.03 119.04 23.02 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -169.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -55.95 150.95 12.52 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.115 -1.402 . . . . 0.0 110.365 171.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 m 67.26 -3.75 0.97 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -147.17 -21.09 0.4 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 121.751 2.069 . . . . 0.0 116.468 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.78 77.16 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 119.867 1.212 . . . . 0.0 115.169 177.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 50.6 m -54.9 158.76 2.59 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.438 1.495 . . . . 0.0 109.519 170.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.16 148.47 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 125.122 1.369 . . . . 0.0 108.931 -176.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.6 p90 -156.88 -169.51 3.0 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.577 1.551 . . . . 0.0 109.166 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -125.83 149.14 48.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 122.503 1.144 . . . . 0.0 109.054 172.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -139.0 124.38 19.28 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.829 1.652 . . . . 0.0 108.139 -172.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -75.73 99.35 4.35 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.995 174.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -68.86 -9.72 53.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.8 mt -94.09 -31.14 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.756 1.622 . . . . 0.0 112.01 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -116.5 -11.1 11.15 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 68.58 10.67 8.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.125 2.97 . . . . 0.0 115.279 -172.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.68 160.88 13.3 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.006 0.821 . . . . 0.0 112.927 170.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 p -143.44 146.21 33.26 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.925 1.29 . . . . 0.0 111.447 175.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -158.2 138.7 12.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.095 1.358 . . . . 0.0 109.005 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -82.77 -19.7 37.29 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.187 -0.946 . . . . 0.0 112.114 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -77.92 142.01 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.55 110.67 42.8 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -169.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.685 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -57.53 179.15 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 124.393 3.395 . . . . 0.0 115.831 168.615 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 97.6 p 70.02 -80.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.278 2.231 . . . . 0.0 111.191 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 C-N-CA 125.727 1.632 . . . . 0.0 113.028 178.545 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.579 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 mtmm . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.557 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 0.6 OUTLIER -73.07 165.31 53.86 Favored Pre-proline 0 CA--C 1.557 1.228 0 CA-C-N 119.685 1.13 . . . . 0.0 111.353 176.645 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.53 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 80.1 Cg_exo -60.75 159.94 26.77 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 126.559 4.84 . . . . 0.0 119.422 -169.636 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -57.17 140.58 93.2 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.17 2.58 . . . . 0.0 106.382 168.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.8 -36.41 4.25 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 116.823 -2.098 . . . . 0.0 110.161 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.58 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 88.4 m95 -69.98 135.68 49.66 Favored 'General case' 0 C--N 1.353 0.728 0 CA-C-N 121.53 2.665 . . . . 0.0 112.89 169.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -151.61 152.5 32.95 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.395 1.078 . . . . 0.0 110.542 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 135.55 57.28 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.613 1.965 . . . . 0.0 112.706 -175.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -136.93 156.75 48.06 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.955 1.302 . . . . 0.0 110.168 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.0 ttt -135.09 139.03 44.38 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.345 0.658 . . . . 0.0 111.203 -173.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.403 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 62.3 m-85 -86.52 103.01 14.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.564 1.146 . . . . 0.0 113.418 -178.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.05 134.63 52.7 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.182 169.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 t 90.19 -7.83 0.35 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.699 2.8 . . . . 0.0 115.743 -178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -141.71 -15.43 0.82 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.41 1.459 . . . . 0.0 114.224 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.73 11.19 83.35 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.383 0.992 . . . . 0.0 114.236 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 51.8 m -64.46 163.61 13.02 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.358 1.079 . . . . 0.0 110.205 170.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.2 t -130.49 149.77 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 125.707 1.603 . . . . 0.0 108.658 -175.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.5 p90 -156.26 -168.23 2.67 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.615 1.966 . . . . 0.0 109.091 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.416 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 3.8 m-85 -128.63 149.66 50.56 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.755 1.222 . . . . 0.0 108.519 173.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -139.22 126.85 21.84 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.272 1.429 . . . . 0.0 108.899 -170.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -78.92 97.63 6.09 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 123.592 0.558 . . . . 0.0 109.713 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -68.89 -7.78 37.88 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.1 mt -92.98 -33.41 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 125.355 1.462 . . . . 0.0 111.76 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.9 p -111.47 -22.31 11.34 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 85.11 6.93 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 130.913 3.685 . . . . 0.0 114.325 -172.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.05 161.78 20.91 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.519 1.054 . . . . 0.0 113.498 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.8 p -136.94 140.98 42.64 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.111 1.364 . . . . 0.0 112.08 174.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -147.15 141.62 26.46 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.114 1.766 . . . . 0.0 107.873 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -81.14 -28.54 35.03 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.507 1.049 . . . . 0.0 112.629 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.14 150.44 37.19 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.08 0.854 . . . . 0.0 110.581 169.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.26 111.31 46.33 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 127.463 2.305 . . . . 0.0 113.563 -169.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.58 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -53.73 -28.07 45.54 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.269 1.979 . . . . 0.0 116.692 169.472 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 63.0 p -63.99 -12.59 39.29 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.694 1.738 . . . . 0.0 115.694 -174.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.103 0 CA-C-O 118.421 -1.211 . . . . 0.0 112.948 176.696 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.403 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 1' ' ' LYS . 13.9 tptp . . . . . 0 N--CA 1.476 0.832 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.366 2.1 mm? -62.52 165.72 8.67 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 124.62 1.168 . . . . 0.0 111.693 169.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.1 159.32 4.14 Favored 'Trans proline' 0 C--N 1.353 0.786 0 N-CA-C 118.115 2.313 . . . . 0.0 118.115 -167.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -50.09 119.1 4.49 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 123.961 3.107 . . . . 0.0 111.72 -169.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.32 -28.65 10.0 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 115.044 -3.087 . . . . 0.0 117.418 -175.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -67.67 121.32 15.66 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 124.134 3.967 . . . . 0.0 115.998 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 8' ' ' LYS . 12.0 tp10 -165.05 163.12 20.65 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.878 2.071 . . . . 0.0 110.742 169.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.52 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.6 ttpm? -49.74 145.63 5.08 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 130.55 3.54 . . . . 0.0 114.521 177.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -141.72 159.57 41.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.397 1.879 . . . . 0.0 109.031 171.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 34.4 ttp -131.94 140.34 48.98 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.338 1.055 . . . . 0.0 110.557 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.455 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 75.4 m-85 -87.27 95.9 10.15 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.829 1.252 . . . . 0.0 113.351 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.33 146.45 28.87 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 169.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.2 p 90.32 -16.82 0.21 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 130.111 3.364 . . . . 0.0 115.098 -169.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -144.23 -19.56 0.56 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.967 1.84 . . . . 0.0 115.967 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.88 6.99 71.47 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-N 119.939 1.245 . . . . 0.0 114.712 178.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -58.35 158.04 7.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 0.0 109.61 170.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.1 t -134.61 148.87 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 125.716 1.606 . . . . 0.0 108.528 -175.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.429 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 10.5 p90 -156.16 -176.47 5.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.611 1.564 . . . . 0.0 109.277 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -123.73 141.39 52.07 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.9 1.333 . . . . 0.0 108.617 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -133.59 136.63 45.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 113.518 -1.674 . . . . 0.0 108.925 -169.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -86.16 92.29 8.7 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 169.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -65.99 2.0 1.25 Allowed 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mp -105.12 -47.55 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.63 1.172 . . . . 0.0 110.969 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.7 p -85.65 -28.85 24.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.539 1.135 . . . . 0.0 113.523 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 85.02 11.97 0.27 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 130.337 3.455 . . . . 0.0 115.019 -172.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.74 19.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.29 0.95 . . . . 0.0 112.322 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.5 p -145.09 136.38 25.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.538 1.135 . . . . 0.0 111.506 176.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -135.15 159.43 41.56 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -84.44 -22.49 30.33 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.745 -1.222 . . . . 0.0 109.338 170.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.24 124.48 24.24 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.712 2.005 . . . . 0.0 109.821 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.2 126.11 57.99 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 127.211 2.204 . . . . 0.0 110.646 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -64.14 160.27 39.05 Favored 'Trans proline' 0 CA--C 1.551 1.338 0 CA-C-N 122.63 1.975 . . . . 0.0 109.858 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.4 m -74.83 58.99 0.86 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.493 0 C-N-CA 126.784 2.135 . . . . 0.0 114.241 176.189 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.455 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.583 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.25 1.7 mp -77.74 165.2 52.82 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 169.172 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 88.5 Cg_exo -60.42 159.94 25.5 Favored 'Trans proline' 0 CA--C 1.541 0.835 1 C-N-CA 126.453 4.769 . . . . 0.0 119.38 -169.56 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -59.59 140.57 94.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.177 2.585 . . . . 0.0 105.698 168.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.74 -35.22 4.92 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-O 116.393 -2.337 . . . . 0.0 110.514 -168.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.501 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 89.6 m95 -70.55 137.66 50.3 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-N 121.295 2.547 . . . . 0.0 112.638 169.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -146.09 141.89 28.0 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.438 1.495 . . . . 0.0 110.555 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -66.32 138.76 57.85 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 121.65 -0.656 . . . . 0.0 111.512 -174.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.4 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -138.67 154.29 48.61 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.279 1.432 . . . . 0.0 109.906 -169.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 22.5 ttp -134.14 137.33 44.44 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.63 0.772 . . . . 0.0 111.183 -172.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.403 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 71.4 m-85 -82.27 102.14 10.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.662 1.185 . . . . 0.0 112.19 175.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -54.16 152.57 5.95 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.306 169.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.6 t 65.5 -4.1 0.61 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -173.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -138.87 -18.87 1.03 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.553 1.978 . . . . 0.0 114.95 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.33 6.54 89.21 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.09 0.852 . . . . 0.0 114.305 173.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.0 m -65.58 160.98 21.26 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.345 1.072 . . . . 0.0 110.197 171.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -134.3 147.31 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 125.868 1.667 . . . . 0.0 109.078 -173.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -156.61 -166.62 2.17 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.658 1.983 . . . . 0.0 108.968 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.419 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 3.9 m-85 -131.44 150.92 51.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.432 1.093 . . . . 0.0 109.256 175.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -133.46 128.3 35.14 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 108.897 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -89.59 96.5 10.73 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.6 p80 -74.63 -1.42 21.58 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.8 mt -92.41 -34.04 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 124.571 1.148 . . . . 0.0 111.547 172.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.2 p -105.55 -21.69 13.15 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.06 6.55 0.48 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 131.407 3.883 . . . . 0.0 114.12 -172.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.99 165.13 20.78 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.5 p -140.32 138.94 35.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.632 1.573 . . . . 0.0 110.257 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -150.0 147.21 27.57 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.42 1.488 . . . . 0.0 108.38 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -90.09 -30.99 17.32 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.634 1.106 . . . . 0.0 110.666 -175.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.72 124.89 21.95 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.707 2.003 . . . . 0.0 108.227 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? -90.11 113.24 56.52 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.087 1.355 . . . . 0.0 113.188 -169.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.588 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 30.1 Cg_exo -52.92 -33.54 62.35 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 123.082 2.522 . . . . 0.0 116.993 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.4 m -156.73 63.8 0.52 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.329 0.652 . . . . 0.0 112.187 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.258 0 CA-C-O 117.965 -1.464 . . . . 0.0 113.192 173.867 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.403 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 117.446 -1.264 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.352 0.3 OUTLIER -66.43 165.49 23.47 Favored Pre-proline 0 CA--C 1.562 1.437 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -169.53 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.479 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 77.6 Cg_exo -74.98 167.46 27.0 Favored 'Trans proline' 0 CA--C 1.55 1.284 1 C-N-CA 127.081 5.188 . . . . 0.0 121.167 -171.445 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -54.17 140.59 71.26 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 123.827 3.018 . . . . 0.0 107.467 167.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.68 -35.86 4.57 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.977 -168.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.577 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 97.0 m95 -73.48 141.88 46.81 Favored 'General case' 0 C--N 1.348 0.535 0 CA-C-N 120.237 2.019 . . . . 0.0 112.136 169.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -150.72 154.56 37.63 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.828 1.251 . . . . 0.0 110.174 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.72 145.0 46.6 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.231 1.413 . . . . 0.0 111.861 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.5 155.29 43.01 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.18 -0.95 . . . . 0.0 110.67 -178.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.3 ttt -135.23 142.68 46.04 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.234 0.614 . . . . 0.0 111.365 -172.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.473 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 67.6 m-85 -95.29 98.12 10.36 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.572 1.149 . . . . 0.0 113.754 -177.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.3 146.62 18.78 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.901 169.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 p 90.04 -19.83 0.16 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 129.67 3.188 . . . . 0.0 114.806 -170.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -141.88 -20.31 0.73 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.48 10.27 77.34 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-N 119.385 0.993 . . . . 0.0 114.727 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.2 m -58.07 160.49 4.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.718 1.207 . . . . 0.0 109.8 170.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.67 149.86 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.575 1.55 . . . . 0.0 108.527 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -155.79 -168.09 2.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.58 1.952 . . . . 0.0 109.745 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.404 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 5.4 m-85 -131.35 149.17 52.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.058 1.343 . . . . 0.0 108.961 174.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -137.1 127.44 26.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.073 1.749 . . . . 0.0 109.395 -171.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 13.5 t-20 -80.21 99.41 7.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.133 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -72.03 -5.98 39.02 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.2 mt -93.61 -33.35 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.071 1.348 . . . . 0.0 111.723 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.5 p -111.29 -22.42 11.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 85.08 7.52 0.44 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.84 3.656 . . . . 0.0 114.452 -173.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.26 163.27 18.3 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 119.361 0.982 . . . . 0.0 113.568 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.6 p -144.96 137.89 26.45 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.914 1.285 . . . . 0.0 112.268 175.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.86 160.13 44.09 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.818 1.247 . . . . 0.0 109.818 169.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -87.94 -27.15 22.3 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -169.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.89 158.54 23.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.77 1.168 . . . . 0.0 111.449 172.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.0 137.31 28.19 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -170.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.588 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -70.6 -175.13 1.25 Allowed 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 124.49 3.46 . . . . 0.0 114.745 168.362 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.3 m 62.93 -66.99 0.09 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.842 2.057 . . . . 0.0 112.405 -171.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.297 0 C-N-CA 125.917 1.722 . . . . 0.0 112.042 173.14 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.473 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.411 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.696 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.29 1.6 mp -142.05 165.76 25.64 Favored Pre-proline 0 CA--C 1.563 1.455 0 O-C-N 120.733 -1.23 . . . . 0.0 111.664 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.553 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 89.7 Cg_exo -60.21 163.7 14.05 Favored 'Trans proline' 0 CA--C 1.546 1.108 1 C-N-CA 127.359 5.373 . . . . 0.0 120.228 -171.197 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -57.49 140.59 93.71 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 123.3 2.667 . . . . 0.0 106.959 168.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.68 -34.88 5.12 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.545 -1.697 . . . . 0.0 109.886 -168.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.7 m95 -73.03 142.32 47.68 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.663 2.231 . . . . 0.0 112.577 169.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -148.28 153.5 38.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.264 1.426 . . . . 0.0 109.829 178.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.89 145.27 36.06 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.431 1.492 . . . . 0.0 111.608 -179.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.47 152.45 39.8 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.802 -1.186 . . . . 0.0 110.286 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.6 ttt -135.26 137.01 42.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.791 0.436 . . . . 0.0 111.929 -172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.44 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 77.1 m-85 -86.83 95.03 9.72 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 125.446 1.499 . . . . 0.0 112.869 178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 144.24 42.25 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.2 p 89.98 -16.24 0.24 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.773 3.229 . . . . 0.0 115.061 -171.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -138.81 -20.47 1.0 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 169.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.8 7.15 78.73 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.294 1.426 . . . . 0.0 114.719 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 41.9 m -60.11 160.16 8.56 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 109.947 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.4 t -131.09 149.41 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 125.631 1.573 . . . . 0.0 107.994 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.75 -168.53 2.93 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.731 2.012 . . . . 0.0 108.577 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.466 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 7.5 m-85 -131.14 153.02 49.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 122.113 0.958 . . . . 0.0 108.779 172.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -135.08 128.56 32.45 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.757 2.023 . . . . 0.0 109.156 -172.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -84.09 100.13 10.92 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -71.92 -3.95 25.48 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.9 mt -98.17 -32.34 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 125.387 1.475 . . . . 0.0 111.831 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.7 p -113.48 -13.43 12.81 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 79.23 1.23 2.34 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 129.164 2.986 . . . . 0.0 114.147 -176.042 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 162.48 9.84 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -140.22 137.51 34.35 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.505 1.522 . . . . 0.0 110.978 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -145.17 144.44 30.87 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.428 1.491 . . . . 0.0 108.207 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -80.64 -19.86 44.41 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.686 -0.634 . . . . 0.0 112.329 -177.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -64.61 154.99 34.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 169.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mtp-105 -90.24 111.7 48.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 125.148 1.379 . . . . 0.0 112.706 171.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.696 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -54.32 -38.94 88.9 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 N-CA-C 116.276 1.606 . . . . 0.0 116.276 169.069 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.9 p -71.9 73.49 0.86 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.357 1.463 . . . . 0.0 111.699 175.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.373 0 C-N-CA 127.305 2.383 . . . . 0.0 112.983 176.791 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.44 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.7 m95 . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -147.42 145.77 29.35 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.453 1.501 . . . . 0.0 111.192 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -63.78 143.25 58.0 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.879 0.847 . . . . 0.0 111.52 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -144.51 151.45 39.15 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.67 1.188 . . . . 0.0 109.823 -172.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.9 ttm -135.09 130.55 35.7 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.347 0.659 . . . . 0.0 111.967 -172.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -78.31 94.96 4.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.472 1.909 . . . . 0.0 112.582 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -58.66 150.39 23.44 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 169.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 p 80.94 -14.85 0.79 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.364 2.666 . . . . 0.0 115.615 -170.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -136.58 -21.31 1.32 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.67 1.577 . . . . 0.0 115.078 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.42 3.3 72.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.686 1.136 . . . . 0.0 114.275 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -62.8 158.82 17.85 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.468 1.107 . . . . 0.0 110.124 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.4 t -131.59 147.96 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.707 1.603 . . . . 0.0 108.384 -175.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -156.58 -167.61 2.45 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.398 1.879 . . . . 0.0 109.078 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -129.44 150.46 50.78 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.069 1.348 . . . . 0.0 109.148 174.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -135.53 127.56 29.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.528 1.531 . . . . 0.0 109.062 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -86.87 97.3 10.58 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -76.16 1.31 16.1 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.8 mt -94.46 -33.82 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 124.439 1.095 . . . . 0.0 111.543 171.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.3 p -108.17 -21.11 12.92 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.1 5.68 0.52 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 131.328 3.851 . . . . 0.0 114.22 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.08 16.11 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.6 p -137.99 144.46 41.12 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.521 1.529 . . . . 0.0 109.838 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -154.31 146.68 23.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.913 1.685 . . . . 0.0 107.87 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.07 -32.08 17.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.988 0.813 . . . . 0.0 111.381 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.01 143.21 49.25 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.351 1.072 . . . . 0.0 110.196 169.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 125.8 1.64 . . . . 0.0 113.868 -169.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.5 m95 . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -145.04 145.5 31.5 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.046 1.338 . . . . 0.0 111.917 169.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -63.56 145.67 55.21 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.465 1.906 . . . . 0.0 111.98 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -141.51 151.45 43.29 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.495 1.118 . . . . 0.0 110.915 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.0 ttp -134.95 136.82 42.54 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.054 0.942 . . . . 0.0 110.812 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -86.28 104.44 15.82 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.734 1.213 . . . . 0.0 113.839 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 157.54 1.83 Allowed 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.786 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m 66.11 -10.68 0.24 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -171.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -140.8 -21.12 0.8 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 122.22 2.282 . . . . 0.0 116.309 171.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.0 7.07 78.28 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.744 1.156 . . . . 0.0 114.445 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 34.6 m -59.84 158.34 10.74 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.483 1.113 . . . . 0.0 109.502 171.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -135.08 146.88 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.269 1.428 . . . . 0.0 109.011 -174.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -156.12 -169.61 3.11 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.271 1.829 . . . . 0.0 109.541 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.47 ' CD1' ' HB2' ' A' ' 31' ' ' ARG . 1.2 m-85 -129.65 155.35 46.0 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.149 0.98 . . . . 0.0 111.308 174.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -133.32 126.79 32.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.206 1.402 . . . . 0.0 109.185 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -90.49 96.32 10.59 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.374 0.67 . . . . 0.0 109.484 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -70.04 -2.21 12.09 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.5 mt -95.05 -31.72 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 119.325 0.966 . . . . 0.0 111.224 174.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.9 p -105.43 -22.15 13.08 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.661 1.184 . . . . 0.0 113.566 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 79.91 9.16 1.47 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 130.047 3.339 . . . . 0.0 113.261 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.34 160.77 26.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.387 0.994 . . . . 0.0 111.801 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -140.19 143.03 35.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.38 1.072 . . . . 0.0 109.102 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -151.71 140.76 21.17 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.507 0.723 . . . . 0.0 109.939 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -86.82 -42.57 13.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.371 1.069 . . . . 0.0 109.469 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -79.23 87.72 4.93 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 125.412 2.53 . . . . 0.0 108.163 169.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.47 ' HB2' ' CD1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.848 0 CA-C-N 109.899 -3.319 . . . . 0.0 114.39 -171.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.9 m95 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -149.28 142.89 25.46 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.927 1.291 . . . . 0.0 111.909 -172.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -60.31 132.94 55.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.45 150.46 47.63 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.048 1.339 . . . . 0.0 109.419 -172.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.9 ttp -135.2 136.48 41.81 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.828 0.451 . . . . 0.0 112.139 -169.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 60.0 m-85 -75.6 109.5 9.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.571 1.548 . . . . 0.0 112.625 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.429 ' NE ' ' H ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -52.32 144.04 13.69 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 114.436 -1.257 . . . . 0.0 110.17 173.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.6 m 64.15 0.43 1.0 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -136.75 -25.63 1.1 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.209 1.822 . . . . 0.0 115.126 169.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.91 3.21 70.77 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 119.216 0.917 . . . . 0.0 114.906 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.3 m -56.01 156.15 5.65 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 109.357 169.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -131.89 148.14 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 C-N-CA 124.969 1.308 . . . . 0.0 108.967 -173.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.402 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.8 p90 -156.42 -170.23 3.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.41 1.884 . . . . 0.0 109.514 178.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 31' ' ' ARG . 2.9 m-85 -127.71 149.0 50.42 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.635 1.174 . . . . 0.0 108.332 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -133.98 127.92 33.33 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.163 1.385 . . . . 0.0 108.898 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -88.99 92.89 9.41 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -71.26 -0.46 9.99 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.3 mt -92.02 -24.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 124.764 1.226 . . . . 0.0 111.47 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.9 p -120.11 -22.46 6.64 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.664 1.586 . . . . 0.0 114.246 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 84.98 7.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 131.205 3.802 . . . . 0.0 114.425 -171.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.07 164.19 18.43 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 119.883 1.22 . . . . 0.0 113.666 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 p -142.49 140.69 31.95 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.297 1.439 . . . . 0.0 111.009 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -151.47 143.67 24.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.456 1.502 . . . . 0.0 108.487 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -83.35 -28.31 29.08 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.756 0.707 . . . . 0.0 112.058 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.37 136.58 51.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.662 0.744 . . . . 0.0 109.647 169.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.455 ' HG3' ' CE1' ' A' ' 19' ' ' TYR . 1.7 ttp-105 . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 128.227 2.611 . . . . 0.0 116.782 -169.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.7 m95 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 121.328 0.585 . . . . 0.0 112.565 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -147.78 144.65 28.37 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.063 1.345 . . . . 0.0 111.364 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -63.09 143.41 57.81 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.866 0.841 . . . . 0.0 111.56 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -147.19 156.73 43.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.028 0.931 . . . . 0.0 110.143 -170.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -134.69 145.05 48.16 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.617 0.767 . . . . 0.0 110.977 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -91.15 114.37 26.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -42.72 133.51 3.48 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.21 2.204 . . . . 0.0 111.363 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m 65.54 1.8 1.82 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -134.96 -17.58 1.87 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 120.653 1.57 . . . . 0.0 114.481 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.39 7.98 87.03 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 119.137 0.88 . . . . 0.0 114.104 173.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 88.6 m -62.42 159.39 15.55 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.439 1.119 . . . . 0.0 109.549 169.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.8 t -131.28 146.9 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 125.939 1.696 . . . . 0.0 108.267 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -159.03 -167.28 2.05 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.858 1.663 . . . . 0.0 109.425 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -129.84 151.22 50.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.868 174.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -137.37 127.67 26.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.369 1.467 . . . . 0.0 109.278 -172.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -86.74 93.71 9.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -72.78 0.77 9.97 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.0 mt -88.89 -26.72 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.188 0.995 . . . . 0.0 111.399 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.4 p -120.1 -24.14 6.1 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.741 1.616 . . . . 0.0 114.668 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 85.13 7.61 0.43 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 131.338 3.855 . . . . 0.0 114.596 -170.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.95 164.43 15.14 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.617 1.099 . . . . 0.0 113.611 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.2 p -137.63 146.94 44.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.555 1.542 . . . . 0.0 110.852 173.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -147.6 154.26 40.44 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 108.595 171.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -90.0 -19.89 23.91 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.437 0.562 . . . . 0.0 111.558 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.36 148.38 51.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 . . . . . 0 CA--C 1.544 0.736 0 C-N-CA 125.538 1.535 . . . . 0.0 113.565 -179.83 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 98.5 m95 . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 162.99 34.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.041 1.336 . . . . 0.0 111.622 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 tmpt? -74.65 131.5 40.95 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.431 0.692 . . . . 0.0 111.473 -177.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -128.27 156.09 43.56 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.298 1.439 . . . . 0.0 110.325 -173.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 14.6 ttt -135.32 143.69 46.31 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.086 0.555 . . . . 0.0 111.462 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -90.38 108.75 19.97 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 147.27 1.06 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.484 1.114 . . . . 0.0 110.918 169.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m 65.0 -5.91 0.37 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -136.15 -17.32 1.6 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.362 1.892 . . . . 0.0 114.754 169.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.16 10.15 84.19 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.788 1.185 . . . . 0.0 114.46 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 m -62.57 162.18 10.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.268 1.034 . . . . 0.0 109.68 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.9 t -128.42 149.01 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.551 1.54 . . . . 0.0 108.342 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -155.3 -163.28 1.5 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.094 2.157 . . . . 0.0 108.17 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -134.17 151.86 51.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 109.025 177.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -134.85 132.56 38.75 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.222 1.409 . . . . 0.0 109.836 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -86.03 97.88 10.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 122.7 0.4 . . . . 0.0 110.027 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -71.7 -9.4 58.21 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 28.1 mt -84.73 -35.25 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 124.443 1.097 . . . . 0.0 111.758 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -112.56 -20.1 11.85 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 85.15 6.29 0.49 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 131.039 3.736 . . . . 0.0 114.424 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.49 165.8 16.01 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -139.61 140.71 37.06 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.613 1.565 . . . . 0.0 111.424 173.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -150.79 149.98 30.41 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.822 1.649 . . . . 0.0 107.933 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.24 -32.7 16.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.185 0.902 . . . . 0.0 111.412 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.5 145.25 56.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.084 0.857 . . . . 0.0 110.2 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 C-N-CA 125.238 1.415 . . . . 0.0 113.123 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -149.72 146.32 27.16 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.649 1.179 . . . . 0.0 110.097 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -67.81 144.72 55.22 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.517 0.675 . . . . 0.0 109.939 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -142.85 152.92 42.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.835 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.0 ttm -135.03 137.47 42.99 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -86.22 100.77 12.47 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.893 1.277 . . . . 0.0 113.545 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.88 146.74 3.08 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.151 0.98 . . . . 0.0 110.394 169.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.2 p 73.13 -9.99 1.07 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.509 2.324 . . . . 0.0 117.036 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -136.22 -21.3 1.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 120.87 1.668 . . . . 0.0 115.239 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.96 5.91 80.15 Favored Glycine 0 CA--C 1.533 1.191 0 CA-C-N 119.312 0.96 . . . . 0.0 114.399 173.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.0 m -61.56 159.55 12.88 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.371 1.069 . . . . 0.0 109.803 172.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -134.41 144.81 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.445 1.498 . . . . 0.0 108.449 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -153.91 -166.69 2.45 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.691 2.396 . . . . 0.0 109.027 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -132.05 151.33 51.82 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.939 0.896 . . . . 0.0 109.966 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -137.39 127.57 26.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.122 1.369 . . . . 0.0 110.012 -172.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -90.78 95.29 10.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.254 0.622 . . . . 0.0 109.565 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -75.11 3.37 8.69 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.293 1.59 . . . . 0.0 115.293 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.8 mt -90.93 -29.85 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 118.864 0.756 . . . . 0.0 111.44 170.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.3 p -112.14 -23.12 10.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.84 1.256 . . . . 0.0 113.787 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 82.9 8.33 0.72 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 130.758 3.623 . . . . 0.0 113.851 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.21 163.05 21.21 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.509 1.049 . . . . 0.0 112.874 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 p -141.61 138.36 32.54 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.029 1.332 . . . . 0.0 110.255 173.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -135.04 148.4 49.89 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.138 172.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.14 -19.94 24.88 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 173.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.1 124.91 25.05 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.068 2.147 . . . . 0.0 107.694 169.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 116.984 -1.484 . . . . 0.0 109.241 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.6 m95 . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -150.2 143.48 25.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.906 1.282 . . . . 0.0 110.989 -173.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -66.2 138.94 58.04 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.516 -0.74 . . . . 0.0 111.71 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.55 154.6 47.67 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.151 1.38 . . . . 0.0 110.626 -169.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 33.8 ttp -135.11 130.25 35.18 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.844 0.858 . . . . 0.0 112.061 -173.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -76.72 97.56 4.51 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.054 1.742 . . . . 0.0 112.666 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -58.95 141.33 54.0 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 169.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 59.1 p 89.43 -14.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 129.497 3.119 . . . . 0.0 115.031 -174.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -137.42 -16.56 1.37 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.23 89.32 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.175 0.898 . . . . 0.0 114.248 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 98.9 m -64.07 160.44 18.12 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.534 1.167 . . . . 0.0 110.241 172.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 t -131.27 147.76 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 126.003 1.721 . . . . 0.0 108.775 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -157.64 -166.06 1.92 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.603 1.961 . . . . 0.0 109.03 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -132.05 150.54 52.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.188 1.395 . . . . 0.0 108.723 175.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -137.76 128.26 26.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.705 1.202 . . . . 0.0 109.249 -172.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -86.59 96.91 10.26 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -73.92 -3.96 32.15 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mt -89.58 -33.34 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 124.514 1.126 . . . . 0.0 111.609 172.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.4 p -109.42 -20.94 12.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 85.02 5.42 0.54 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 131.44 3.896 . . . . 0.0 114.376 -172.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.41 163.86 19.92 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.7 p -137.76 141.06 40.95 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.519 1.528 . . . . 0.0 111.09 171.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -148.45 147.69 29.43 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.325 1.85 . . . . 0.0 107.359 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.16 -28.78 19.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.158 0.89 . . . . 0.0 110.808 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 144.94 53.4 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.739 0.78 . . . . 0.0 109.983 169.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 C-N-CA 126.694 1.998 . . . . 0.0 114.73 -171.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.0 m95 . . . . . 0 N--CA 1.465 0.311 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -149.37 148.38 29.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.354 1.462 . . . . 0.0 110.439 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -65.73 144.87 56.62 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.97 0.804 . . . . 0.0 111.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -145.97 153.59 40.96 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.546 0.739 . . . . 0.0 110.443 -171.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.5 ttm -130.98 132.76 45.24 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.642 0.777 . . . . 0.0 110.786 -176.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -76.61 106.7 8.42 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.781 1.632 . . . . 0.0 113.007 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.437 ' NE ' ' H ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -53.95 146.8 13.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.578 169.893 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.3 p 73.82 -9.14 1.27 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.208 2.203 . . . . 0.0 116.805 -175.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.71 -20.88 0.91 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 169.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.44 4.55 80.27 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-N 119.652 1.114 . . . . 0.0 114.543 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 m -59.68 160.04 7.85 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.612 1.165 . . . . 0.0 109.899 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -129.73 147.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 125.237 1.415 . . . . 0.0 108.779 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -159.05 -168.16 2.29 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.191 1.796 . . . . 0.0 109.294 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -129.0 149.28 50.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.699 1.199 . . . . 0.0 108.843 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -139.02 126.1 21.21 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.361 1.464 . . . . 0.0 109.314 -169.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -85.85 93.58 8.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -72.55 0.5 10.27 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.8 mt -89.56 -25.91 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.14 0.976 . . . . 0.0 111.428 173.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.7 p -120.09 -23.92 6.17 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.463 1.505 . . . . 0.0 114.485 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 85.08 7.41 0.45 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 131.371 3.869 . . . . 0.0 114.544 -170.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.14 15.99 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.705 1.139 . . . . 0.0 113.544 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.9 p -141.4 142.67 33.72 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.088 1.355 . . . . 0.0 111.85 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -149.65 146.54 27.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.585 1.554 . . . . 0.0 107.985 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -84.6 -28.28 26.65 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.394 0.997 . . . . 0.0 112.465 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.09 148.01 40.11 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.219 0.918 . . . . 0.0 110.617 169.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.053 1.341 . . . . 0.0 114.057 -169.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . 93.1 m95 . . . . . 0 CA--C 1.537 0.453 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -151.04 152.61 33.72 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.987 1.315 . . . . 0.0 110.182 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 136.68 57.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.72 2.008 . . . . 0.0 112.266 -172.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 -135.24 152.32 51.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.421 1.088 . . . . 0.0 110.348 -174.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 13.7 ttt -135.23 130.53 35.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.127 0.571 . . . . 0.0 111.701 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 67.6 m-85 -79.38 95.02 5.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.724 1.209 . . . . 0.0 113.596 -176.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -58.31 141.41 51.11 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 90.45 -13.33 0.28 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 129.427 3.091 . . . . 0.0 114.954 -169.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -143.36 -21.35 0.61 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.982 1.719 . . . . 0.0 115.411 169.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.52 77.56 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 125.215 1.388 . . . . 0.0 114.754 175.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 m -59.71 162.08 5.59 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.555 1.142 . . . . 0.0 109.982 171.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.8 t -129.8 148.54 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 125.586 1.554 . . . . 0.0 108.084 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 8.1 p90 -155.97 -163.47 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.35 2.26 . . . . 0.0 108.126 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -136.51 153.22 51.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.719 1.208 . . . . 0.0 109.388 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -140.87 127.33 19.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.722 1.209 . . . . 0.0 109.514 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 14.8 t-20 -79.99 98.45 7.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -69.98 -10.18 57.74 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.1 mt -87.06 -35.5 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.593 1.157 . . . . 0.0 111.729 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.3 p -110.17 -21.98 12.0 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 85.01 7.33 0.46 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 130.836 3.654 . . . . 0.0 114.091 -172.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.67 163.57 18.74 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.27 0.941 . . . . 0.0 113.35 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.5 p -135.95 144.44 45.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.283 1.433 . . . . 0.0 111.516 174.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -144.92 154.46 42.62 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.856 1.662 . . . . 0.0 107.597 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -90.1 -19.92 23.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.671 0.669 . . . . 0.0 110.099 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.61 144.47 57.19 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 169.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.677 0 C-N-CA 127.27 2.228 . . . . 0.0 114.153 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 98.4 m95 . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.426 0.631 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.99 142.76 30.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.383 1.473 . . . . 0.0 111.189 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -62.91 144.51 56.67 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 122.068 0.937 . . . . 0.0 111.811 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -146.65 153.37 40.23 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.022 0.929 . . . . 0.0 110.063 -169.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 35.2 ttm -133.42 129.81 37.83 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.106 0.562 . . . . 0.0 111.923 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.3 96.31 2.8 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.782 1.633 . . . . 0.0 111.478 173.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt-85 -59.75 155.58 15.7 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.046 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.1 t 65.84 -4.87 0.57 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -136.24 -20.3 1.43 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 121.376 1.898 . . . . 0.0 114.299 169.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.83 3.18 88.2 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.626 1.108 . . . . 0.0 114.157 172.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 93.2 m -65.87 158.38 28.08 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.364 1.082 . . . . 0.0 109.988 173.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.6 t -135.0 142.71 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.914 1.686 . . . . 0.0 108.269 -173.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -154.11 -166.05 2.26 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 127.156 2.182 . . . . 0.0 108.738 -172.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -131.47 151.94 51.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.439 1.096 . . . . 0.0 110.394 176.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -137.97 127.27 24.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.446 1.498 . . . . 0.0 109.23 -173.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -86.55 94.38 9.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -74.02 0.6 13.14 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.93 -27.68 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.037 0.935 . . . . 0.0 111.286 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.8 p -120.06 -24.29 6.08 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.899 1.68 . . . . 0.0 114.864 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 85.22 8.33 0.4 Allowed 'General case' 0 CA--C 1.549 0.935 1 C-N-CA 131.711 4.004 . . . . 0.0 114.685 -169.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.54 167.18 13.38 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 119.815 1.189 . . . . 0.0 114.043 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.8 p -140.18 143.53 36.14 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.937 1.695 . . . . 0.0 111.318 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 155.14 43.96 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.129 1.371 . . . . 0.0 107.799 171.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.03 -19.95 23.81 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.945 175.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -71.59 151.94 43.35 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.127 1.33 . . . . 0.0 109.309 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.964 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.9 m95 . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -152.37 148.75 27.86 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.354 1.062 . . . . 0.0 112.027 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 128.2 34.93 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.594 2.358 . . . . 0.0 112.164 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.59 156.28 46.04 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.189 1.395 . . . . 0.0 109.56 -170.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.9 ttm -135.06 142.21 46.27 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.237 0.615 . . . . 0.0 111.256 -172.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.405 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 75.1 m-85 -89.63 99.79 12.72 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.859 1.263 . . . . 0.0 113.373 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.28 147.64 2.2 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.128 0.971 . . . . 0.0 110.728 169.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.3 p 72.31 -10.5 0.9 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 127.489 2.315 . . . . 0.0 116.945 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -134.71 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.961 1.709 . . . . 0.0 114.945 169.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.67 5.94 80.91 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 119.055 0.843 . . . . 0.0 114.257 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 m -61.02 158.83 12.66 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.157 0.983 . . . . 0.0 109.682 172.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 t -132.53 148.26 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.58 1.552 . . . . 0.0 108.278 -177.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 6.8 p90 -157.4 -165.09 1.71 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.709 2.004 . . . . 0.0 108.245 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -130.84 154.07 48.43 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.522 1.129 . . . . 0.0 110.384 173.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.87 130.59 27.6 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.991 -1.459 . . . . 0.0 109.068 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -85.02 95.29 9.04 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -69.32 -0.21 5.93 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.0 mt -100.48 -27.2 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.428 1.091 . . . . 0.0 111.776 177.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -112.19 -24.45 9.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.142 1.377 . . . . 0.0 113.85 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 83.84 8.28 0.58 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 130.143 3.377 . . . . 0.0 113.707 -169.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.35 165.62 11.49 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.504 1.047 . . . . 0.0 112.741 176.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 p -139.52 154.02 47.59 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.946 1.299 . . . . 0.0 110.448 174.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -149.93 151.31 33.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.306 1.442 . . . . 0.0 107.805 169.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -87.01 -19.63 28.4 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.476 0.58 . . . . 0.0 109.724 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.22 128.5 35.87 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 168.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 -169.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 96.0 m95 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 121.192 0.52 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -147.0 150.61 35.48 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.218 1.007 . . . . 0.0 111.133 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.79 134.76 42.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.011 2.124 . . . . 0.0 112.88 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -135.77 152.78 51.46 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.202 1.401 . . . . 0.0 109.531 -178.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.7 ttt -135.17 129.74 34.27 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.018 0.527 . . . . 0.0 111.915 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 44.9 m-85 -81.03 119.04 23.02 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -169.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -55.95 150.95 12.52 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.115 -1.402 . . . . 0.0 110.365 171.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 m 67.26 -3.75 0.97 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -147.17 -21.09 0.4 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 121.751 2.069 . . . . 0.0 116.468 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.78 77.16 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 119.867 1.212 . . . . 0.0 115.169 177.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 50.6 m -54.9 158.76 2.59 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.438 1.495 . . . . 0.0 109.519 170.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.16 148.47 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 125.122 1.369 . . . . 0.0 108.931 -176.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.6 p90 -156.88 -169.51 3.0 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.577 1.551 . . . . 0.0 109.166 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -125.83 149.14 48.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 122.503 1.144 . . . . 0.0 109.054 172.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -139.0 124.38 19.28 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.829 1.652 . . . . 0.0 108.139 -172.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -75.73 99.35 4.35 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.995 174.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -68.86 -9.72 53.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.8 mt -94.09 -31.14 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.756 1.622 . . . . 0.0 112.01 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -116.5 -11.1 11.15 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 68.58 10.67 8.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.125 2.97 . . . . 0.0 115.279 -172.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.68 160.88 13.3 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.006 0.821 . . . . 0.0 112.927 170.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 p -143.44 146.21 33.26 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.925 1.29 . . . . 0.0 111.447 175.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -158.2 138.7 12.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.095 1.358 . . . . 0.0 109.005 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -82.77 -19.7 37.29 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.187 -0.946 . . . . 0.0 112.114 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -77.92 142.01 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.905 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -169.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.4 m95 . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -151.61 152.5 32.95 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.395 1.078 . . . . 0.0 110.542 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 135.55 57.28 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.613 1.965 . . . . 0.0 112.706 -175.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -136.93 156.75 48.06 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.955 1.302 . . . . 0.0 110.168 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.0 ttt -135.09 139.03 44.38 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.345 0.658 . . . . 0.0 111.203 -173.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.4 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 62.3 m-85 -86.52 103.01 14.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.564 1.146 . . . . 0.0 113.418 -178.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.05 134.63 52.7 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.182 169.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 t 90.19 -7.83 0.35 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.699 2.8 . . . . 0.0 115.743 -178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -141.71 -15.43 0.82 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.41 1.459 . . . . 0.0 114.224 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.73 11.19 83.35 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.383 0.992 . . . . 0.0 114.236 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 51.8 m -64.46 163.61 13.02 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.358 1.079 . . . . 0.0 110.205 170.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.2 t -130.49 149.77 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 125.707 1.603 . . . . 0.0 108.658 -175.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.5 p90 -156.26 -168.23 2.67 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.615 1.966 . . . . 0.0 109.091 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -128.63 149.66 50.56 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.755 1.222 . . . . 0.0 108.519 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -139.22 126.85 21.84 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.272 1.429 . . . . 0.0 108.899 -170.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -78.92 97.63 6.09 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 123.592 0.558 . . . . 0.0 109.713 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -68.89 -7.78 37.88 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.1 mt -92.98 -33.41 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 125.355 1.462 . . . . 0.0 111.76 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.9 p -111.47 -22.31 11.34 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 85.11 6.93 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 130.913 3.685 . . . . 0.0 114.325 -172.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.05 161.78 20.91 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.519 1.054 . . . . 0.0 113.498 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.8 p -136.94 140.98 42.64 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.111 1.364 . . . . 0.0 112.08 174.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -147.15 141.62 26.46 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.114 1.766 . . . . 0.0 107.873 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -81.14 -28.54 35.03 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.507 1.049 . . . . 0.0 112.629 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.14 150.44 37.19 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.08 0.854 . . . . 0.0 110.581 169.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 C-N-CA 127.463 2.305 . . . . 0.0 113.563 -169.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 m95 . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 8' ' ' LYS . 12.0 tp10 -165.05 163.12 20.65 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.878 2.071 . . . . 0.0 110.742 169.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.52 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.6 ttpm? -49.74 145.63 5.08 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 130.55 3.54 . . . . 0.0 114.521 177.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -141.72 159.57 41.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.397 1.879 . . . . 0.0 109.031 171.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 34.4 ttp -131.94 140.34 48.98 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.338 1.055 . . . . 0.0 110.557 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.429 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 75.4 m-85 -87.27 95.9 10.15 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.829 1.252 . . . . 0.0 113.351 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.33 146.45 28.87 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 169.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.2 p 90.32 -16.82 0.21 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 130.111 3.364 . . . . 0.0 115.098 -169.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -144.23 -19.56 0.56 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.967 1.84 . . . . 0.0 115.967 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.88 6.99 71.47 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-N 119.939 1.245 . . . . 0.0 114.712 178.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -58.35 158.04 7.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 0.0 109.61 170.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.1 t -134.61 148.87 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 125.716 1.606 . . . . 0.0 108.528 -175.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.429 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 10.5 p90 -156.16 -176.47 5.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.611 1.564 . . . . 0.0 109.277 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -123.73 141.39 52.07 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.9 1.333 . . . . 0.0 108.617 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -133.59 136.63 45.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 113.518 -1.674 . . . . 0.0 108.925 -169.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -86.16 92.29 8.7 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 169.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -65.99 2.0 1.25 Allowed 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mp -105.12 -47.55 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.63 1.172 . . . . 0.0 110.969 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.7 p -85.65 -28.85 24.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.539 1.135 . . . . 0.0 113.523 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 85.02 11.97 0.27 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 130.337 3.455 . . . . 0.0 115.019 -172.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.74 19.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.29 0.95 . . . . 0.0 112.322 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.5 p -145.09 136.38 25.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.538 1.135 . . . . 0.0 111.506 176.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -135.15 159.43 41.56 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -84.44 -22.49 30.33 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.745 -1.222 . . . . 0.0 109.338 170.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.24 124.48 24.24 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.712 2.005 . . . . 0.0 109.821 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.625 0 C-N-CA 127.211 2.204 . . . . 0.0 110.646 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.6 m95 . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -146.09 141.89 28.0 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.438 1.495 . . . . 0.0 110.555 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -66.32 138.76 57.85 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 121.65 -0.656 . . . . 0.0 111.512 -174.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.4 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -138.67 154.29 48.61 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.279 1.432 . . . . 0.0 109.906 -169.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 22.5 ttp -134.14 137.33 44.44 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.63 0.772 . . . . 0.0 111.183 -172.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -82.27 102.14 10.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.662 1.185 . . . . 0.0 112.19 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -54.16 152.57 5.95 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.306 169.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.6 t 65.5 -4.1 0.61 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -173.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -138.87 -18.87 1.03 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.553 1.978 . . . . 0.0 114.95 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.33 6.54 89.21 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.09 0.852 . . . . 0.0 114.305 173.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.0 m -65.58 160.98 21.26 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.345 1.072 . . . . 0.0 110.197 171.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -134.3 147.31 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 125.868 1.667 . . . . 0.0 109.078 -173.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -156.61 -166.62 2.17 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.658 1.983 . . . . 0.0 108.968 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -131.44 150.92 51.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.432 1.093 . . . . 0.0 109.256 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -133.46 128.3 35.14 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 108.897 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -89.59 96.5 10.73 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.6 p80 -74.63 -1.42 21.58 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.8 mt -92.41 -34.04 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 124.571 1.148 . . . . 0.0 111.547 172.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.2 p -105.55 -21.69 13.15 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.06 6.55 0.48 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 131.407 3.883 . . . . 0.0 114.12 -172.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.99 165.13 20.78 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.5 p -140.32 138.94 35.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.632 1.573 . . . . 0.0 110.257 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -150.0 147.21 27.57 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.42 1.488 . . . . 0.0 108.38 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -90.09 -30.99 17.32 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.634 1.106 . . . . 0.0 110.666 -175.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.72 124.89 21.95 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.707 2.003 . . . . 0.0 108.227 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? . . . . . 0 CA--C 1.538 0.507 0 C-N-CA 125.087 1.355 . . . . 0.0 113.188 -169.425 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . 97.0 m95 . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -150.72 154.56 37.63 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.828 1.251 . . . . 0.0 110.174 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.72 145.0 46.6 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.231 1.413 . . . . 0.0 111.861 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.5 155.29 43.01 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.18 -0.95 . . . . 0.0 110.67 -178.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.3 ttt -135.23 142.68 46.04 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.234 0.614 . . . . 0.0 111.365 -172.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -95.29 98.12 10.36 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.572 1.149 . . . . 0.0 113.754 -177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.3 146.62 18.78 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.901 169.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 p 90.04 -19.83 0.16 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 129.67 3.188 . . . . 0.0 114.806 -170.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -141.88 -20.31 0.73 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.48 10.27 77.34 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-N 119.385 0.993 . . . . 0.0 114.727 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.2 m -58.07 160.49 4.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.718 1.207 . . . . 0.0 109.8 170.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.67 149.86 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.575 1.55 . . . . 0.0 108.527 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -155.79 -168.09 2.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.58 1.952 . . . . 0.0 109.745 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -131.35 149.17 52.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.058 1.343 . . . . 0.0 108.961 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -137.1 127.44 26.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.073 1.749 . . . . 0.0 109.395 -171.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 13.5 t-20 -80.21 99.41 7.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.133 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -72.03 -5.98 39.02 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.2 mt -93.61 -33.35 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.071 1.348 . . . . 0.0 111.723 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.5 p -111.29 -22.42 11.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 85.08 7.52 0.44 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.84 3.656 . . . . 0.0 114.452 -173.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.26 163.27 18.3 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 119.361 0.982 . . . . 0.0 113.568 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.6 p -144.96 137.89 26.45 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.914 1.285 . . . . 0.0 112.268 175.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.86 160.13 44.09 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.818 1.247 . . . . 0.0 109.818 169.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -87.94 -27.15 22.3 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -169.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.89 158.54 23.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.77 1.168 . . . . 0.0 111.449 172.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.7 m95 . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -148.28 153.5 38.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.264 1.426 . . . . 0.0 109.829 178.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.89 145.27 36.06 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.431 1.492 . . . . 0.0 111.608 -179.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.47 152.45 39.8 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.802 -1.186 . . . . 0.0 110.286 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.6 ttt -135.26 137.01 42.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.791 0.436 . . . . 0.0 111.929 -172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -86.83 95.03 9.72 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 125.446 1.499 . . . . 0.0 112.869 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 144.24 42.25 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.2 p 89.98 -16.24 0.24 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.773 3.229 . . . . 0.0 115.061 -171.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -138.81 -20.47 1.0 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 169.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.8 7.15 78.73 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.294 1.426 . . . . 0.0 114.719 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 41.9 m -60.11 160.16 8.56 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 109.947 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.4 t -131.09 149.41 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 125.631 1.573 . . . . 0.0 107.994 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.75 -168.53 2.93 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.731 2.012 . . . . 0.0 108.577 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -131.14 153.02 49.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 122.113 0.958 . . . . 0.0 108.779 172.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -135.08 128.56 32.45 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.757 2.023 . . . . 0.0 109.156 -172.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -84.09 100.13 10.92 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -71.92 -3.95 25.48 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.9 mt -98.17 -32.34 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 125.387 1.475 . . . . 0.0 111.831 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.7 p -113.48 -13.43 12.81 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 79.23 1.23 2.34 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 129.164 2.986 . . . . 0.0 114.147 -176.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 162.48 9.84 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -140.22 137.51 34.35 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.505 1.522 . . . . 0.0 110.978 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -145.17 144.44 30.87 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.428 1.491 . . . . 0.0 108.207 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -80.64 -19.86 44.41 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.686 -0.634 . . . . 0.0 112.329 -177.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -64.61 154.99 34.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 169.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mtp-105 . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 125.148 1.379 . . . . 0.0 112.706 171.584 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 117.362 -1.304 . . . . 0.0 108.304 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.612 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.251 0.3 OUTLIER -74.54 165.35 54.39 Favored Pre-proline 0 CA--C 1.559 1.301 0 CA-C-N 119.685 1.13 . . . . 0.0 110.142 169.714 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.496 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 73.1 Cg_exo -65.31 159.92 44.95 Favored 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.285 4.657 . . . . 0.0 119.874 -169.696 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -53.84 140.37 67.98 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.513 2.809 . . . . 0.0 107.517 168.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.55 -35.79 4.62 Favored Glycine 0 CA--C 1.524 0.611 0 CA-C-O 116.966 -2.019 . . . . 0.0 111.05 -169.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.563 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 86.7 m95 -69.56 139.33 53.72 Favored 'General case' 0 C--N 1.354 0.776 0 CA-C-N 120.707 2.254 . . . . 0.0 113.43 169.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -147.42 145.77 29.35 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.453 1.501 . . . . 0.0 111.192 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -63.78 143.25 58.0 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.879 0.847 . . . . 0.0 111.52 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -144.51 151.45 39.15 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.67 1.188 . . . . 0.0 109.823 -172.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.9 ttm -135.09 130.55 35.7 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.347 0.659 . . . . 0.0 111.967 -172.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.434 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 79.5 m-85 -78.31 94.96 4.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.472 1.909 . . . . 0.0 112.582 176.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -58.66 150.39 23.44 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 169.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 p 80.94 -14.85 0.79 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.364 2.666 . . . . 0.0 115.615 -170.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -136.58 -21.31 1.32 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.67 1.577 . . . . 0.0 115.078 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.42 3.3 72.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.686 1.136 . . . . 0.0 114.275 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -62.8 158.82 17.85 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.468 1.107 . . . . 0.0 110.124 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.4 t -131.59 147.96 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.707 1.603 . . . . 0.0 108.384 -175.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -156.58 -167.61 2.45 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.398 1.879 . . . . 0.0 109.078 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.435 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 4.7 m-85 -129.44 150.46 50.78 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.069 1.348 . . . . 0.0 109.148 174.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -135.53 127.56 29.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.528 1.531 . . . . 0.0 109.062 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -86.87 97.3 10.58 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -76.16 1.31 16.1 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.8 mt -94.46 -33.82 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 124.439 1.095 . . . . 0.0 111.543 171.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.3 p -108.17 -21.11 12.92 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.1 5.68 0.52 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 131.328 3.851 . . . . 0.0 114.22 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.08 16.11 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.6 p -137.99 144.46 41.12 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.521 1.529 . . . . 0.0 109.838 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -154.31 146.68 23.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.913 1.685 . . . . 0.0 107.87 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.07 -32.08 17.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.988 0.813 . . . . 0.0 111.381 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.01 143.21 49.25 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.351 1.072 . . . . 0.0 110.196 169.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.5 116.6 66.76 Favored Pre-proline 0 CA--C 1.538 0.49 0 C-N-CA 125.8 1.64 . . . . 0.0 113.868 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.612 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 18.6 Cg_exo -53.56 -24.93 30.79 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.796 2.997 . . . . 0.0 116.833 170.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.2 p -114.09 -82.06 0.6 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.413 1.485 . . . . 0.0 110.273 169.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.431 0 C-N-CA 124.831 1.205 . . . . 0.0 114.525 -176.771 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.434 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 mtmm . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.584 0.706 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.561 HD12 ' CE2' ' A' ' 19' ' ' TYR . 18.8 mt -148.24 177.43 1.79 Allowed Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 129.033 2.933 . . . . 0.0 107.641 -169.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -53.9 159.92 6.57 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.146 1.897 . . . . 0.0 114.409 -169.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -30.45 100.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.821 1 C-N-CA 125.636 4.224 . . . . 0.0 117.014 -169.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.08 -25.13 17.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 127.644 2.545 . . . . 0.0 115.77 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -72.05 129.07 37.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.077 2.439 . . . . 0.0 116.317 -169.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -145.04 145.5 31.5 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.046 1.338 . . . . 0.0 111.917 169.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -63.56 145.67 55.21 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.465 1.906 . . . . 0.0 111.98 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -141.51 151.45 43.29 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.495 1.118 . . . . 0.0 110.915 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.0 ttp -134.95 136.82 42.54 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.054 0.942 . . . . 0.0 110.812 -174.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.493 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 68.1 m-85 -86.28 104.44 15.82 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.734 1.213 . . . . 0.0 113.839 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 157.54 1.83 Allowed 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.786 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m 66.11 -10.68 0.24 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -171.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -140.8 -21.12 0.8 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 122.22 2.282 . . . . 0.0 116.309 171.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.0 7.07 78.28 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.744 1.156 . . . . 0.0 114.445 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 34.6 m -59.84 158.34 10.74 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.483 1.113 . . . . 0.0 109.502 171.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -135.08 146.88 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.269 1.428 . . . . 0.0 109.011 -174.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -156.12 -169.61 3.11 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.271 1.829 . . . . 0.0 109.541 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.561 ' CE2' HD12 ' A' ' 2' ' ' LEU . 1.2 m-85 -129.65 155.35 46.0 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.149 0.98 . . . . 0.0 111.308 174.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -133.32 126.79 32.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.206 1.402 . . . . 0.0 109.185 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -90.49 96.32 10.59 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.374 0.67 . . . . 0.0 109.484 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -70.04 -2.21 12.09 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -177.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.5 mt -95.05 -31.72 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 119.325 0.966 . . . . 0.0 111.224 174.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.9 p -105.43 -22.15 13.08 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.661 1.184 . . . . 0.0 113.566 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 79.91 9.16 1.47 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 130.047 3.339 . . . . 0.0 113.261 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.34 160.77 26.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.387 0.994 . . . . 0.0 111.801 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -140.19 143.03 35.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.38 1.072 . . . . 0.0 109.102 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -151.71 140.76 21.17 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.507 0.723 . . . . 0.0 109.939 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -86.82 -42.57 13.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.371 1.069 . . . . 0.0 109.469 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -79.23 87.72 4.93 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 125.412 2.53 . . . . 0.0 108.163 169.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.47 ' HB2' ' CD1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -76.18 142.65 72.25 Favored Pre-proline 0 C--N 1.316 -0.848 0 CA-C-N 109.899 -3.319 . . . . 0.0 114.39 -171.326 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.495 ' HG2' HD13 ' A' ' 2' ' ' LEU . 14.9 Cg_endo -52.65 165.07 1.22 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.06 1.173 . . . . 0.0 109.974 169.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 m -55.71 72.45 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.644 2.831 . . . . 0.0 118.644 -169.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.095 0 C-N-CA 125.241 1.4 . . . . 0.0 114.917 169.911 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.493 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.473 ' HZ1' ' CD ' ' A' ' 30' ' ' GLU . 39.6 mtpt . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 116.761 -1.59 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.641 HD13 ' HG3' ' A' ' 32' ' ' PRO 0.284 0.4 OUTLIER -138.89 161.58 57.36 Favored Pre-proline 0 CA--C 1.556 1.18 0 CA-C-N 120.392 1.451 . . . . 0.0 112.948 178.193 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.471 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 76.7 Cg_exo -66.98 160.57 46.54 Favored 'Trans proline' 0 CA--C 1.543 0.954 1 C-N-CA 126.49 4.794 . . . . 0.0 120.44 -169.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -58.24 140.64 95.07 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.133 2.555 . . . . 0.0 105.805 168.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.83 -32.57 6.47 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 116.59 -2.228 . . . . 0.0 110.76 -168.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.557 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.9 m95 -71.76 137.96 48.07 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 121.215 2.508 . . . . 0.0 112.665 169.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -149.28 142.89 25.46 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.927 1.291 . . . . 0.0 111.909 -172.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -60.31 132.94 55.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.45 150.46 47.63 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.048 1.339 . . . . 0.0 109.419 -172.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.9 ttp -135.2 136.48 41.81 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.828 0.451 . . . . 0.0 112.139 -169.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 60.0 m-85 -75.6 109.5 9.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.571 1.548 . . . . 0.0 112.625 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.429 ' NE ' ' H ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -52.32 144.04 13.69 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 114.436 -1.257 . . . . 0.0 110.17 173.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.6 m 64.15 0.43 1.0 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -136.75 -25.63 1.1 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.209 1.822 . . . . 0.0 115.126 169.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.91 3.21 70.77 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 119.216 0.917 . . . . 0.0 114.906 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.3 m -56.01 156.15 5.65 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 109.357 169.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -131.89 148.14 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 C-N-CA 124.969 1.308 . . . . 0.0 108.967 -173.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.402 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.8 p90 -156.42 -170.23 3.28 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.41 1.884 . . . . 0.0 109.514 178.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 31' ' ' ARG . 2.9 m-85 -127.71 149.0 50.42 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.635 1.174 . . . . 0.0 108.332 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -133.98 127.92 33.33 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.163 1.385 . . . . 0.0 108.898 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -88.99 92.89 9.41 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -71.26 -0.46 9.99 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.3 mt -92.02 -24.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 124.764 1.226 . . . . 0.0 111.47 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.9 p -120.11 -22.46 6.64 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.664 1.586 . . . . 0.0 114.246 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 84.98 7.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 131.205 3.802 . . . . 0.0 114.425 -171.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.07 164.19 18.43 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 119.883 1.22 . . . . 0.0 113.666 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 p -142.49 140.69 31.95 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.297 1.439 . . . . 0.0 111.009 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -151.47 143.67 24.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.456 1.502 . . . . 0.0 108.487 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -83.35 -28.31 29.08 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.756 0.707 . . . . 0.0 112.058 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.473 ' CD ' ' HZ1' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -69.37 136.58 51.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.662 0.744 . . . . 0.0 109.647 169.757 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.455 ' HG3' ' CE1' ' A' ' 19' ' ' TYR . 1.7 ttp-105 -90.3 110.77 43.05 Favored Pre-proline 0 CA--C 1.542 0.673 0 C-N-CA 128.227 2.611 . . . . 0.0 116.782 -169.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.641 ' HG3' HD13 ' A' ' 2' ' ' LEU . 74.8 Cg_exo -61.0 171.06 4.1 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.401 2.067 . . . . 0.0 112.195 169.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.4 p 175.19 72.72 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 172.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.409 ' C ' ' H3 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 CA--C 1.533 1.192 0 N-CA-C 107.065 -2.414 . . . . 0.0 107.065 -168.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.794 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 0.7 OUTLIER -139.73 165.83 28.36 Favored Pre-proline 0 CA--C 1.566 1.567 0 C-N-CA 127.229 2.212 . . . . 0.0 108.838 174.406 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.564 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 93.8 Cg_exo -63.1 166.12 15.24 Favored 'Trans proline' 0 CA--C 1.551 1.36 1 C-N-CA 128.142 5.895 . . . . 0.0 121.586 -172.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -55.0 140.43 79.87 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 123.496 2.798 . . . . 0.0 107.463 168.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.5 -33.79 5.75 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.419 -1.212 . . . . 0.0 110.185 -169.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.437 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 97.7 m95 -76.5 140.61 41.26 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 118.999 1.399 . . . . 0.0 112.565 169.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -147.78 144.65 28.37 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.063 1.345 . . . . 0.0 111.364 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -63.09 143.41 57.81 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.866 0.841 . . . . 0.0 111.56 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -147.19 156.73 43.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.028 0.931 . . . . 0.0 110.143 -170.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -134.69 145.05 48.16 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.617 0.767 . . . . 0.0 110.977 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.458 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 57.0 m-85 -91.15 114.37 26.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -42.72 133.51 3.48 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 127.21 2.204 . . . . 0.0 111.363 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m 65.54 1.8 1.82 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -134.96 -17.58 1.87 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 120.653 1.57 . . . . 0.0 114.481 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.39 7.98 87.03 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 119.137 0.88 . . . . 0.0 114.104 173.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 88.6 m -62.42 159.39 15.55 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.439 1.119 . . . . 0.0 109.549 169.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.8 t -131.28 146.9 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 125.939 1.696 . . . . 0.0 108.267 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -159.03 -167.28 2.05 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.858 1.663 . . . . 0.0 109.425 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.426 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.3 m-85 -129.84 151.22 50.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.868 174.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -137.37 127.67 26.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.369 1.467 . . . . 0.0 109.278 -172.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -86.74 93.71 9.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -72.78 0.77 9.97 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.0 mt -88.89 -26.72 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.188 0.995 . . . . 0.0 111.399 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.4 p -120.1 -24.14 6.1 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.741 1.616 . . . . 0.0 114.668 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 85.13 7.61 0.43 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 131.338 3.855 . . . . 0.0 114.596 -170.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.95 164.43 15.14 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.617 1.099 . . . . 0.0 113.611 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.2 p -137.63 146.94 44.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.555 1.542 . . . . 0.0 110.852 173.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -147.6 154.26 40.44 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 108.595 171.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -90.0 -19.89 23.91 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.437 0.562 . . . . 0.0 111.558 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.36 148.38 51.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -90.53 99.91 2.37 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 125.538 1.535 . . . . 0.0 113.565 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.794 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -39.98 -60.53 0.55 Allowed 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.27 3.313 . . . . 0.0 116.892 169.625 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.6 t -147.51 121.37 9.32 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.652 1.581 . . . . 0.0 108.895 170.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 C-N-CA 126.122 1.82 . . . . 0.0 110.981 -174.144 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.458 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.6 mttp . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 117.817 -1.087 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.728 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.28 0.0 OUTLIER -66.16 165.77 20.44 Favored Pre-proline 0 CA--C 1.569 1.692 0 CA-C-N 119.862 1.21 . . . . 0.0 113.886 -179.696 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.481 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 61.1 Cg_exo -74.99 171.96 17.29 Favored 'Trans proline' 0 CA--C 1.558 1.712 1 C-N-CA 128.294 5.996 . . . . 0.0 122.218 -175.189 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -55.5 140.52 83.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 123.818 3.012 . . . . 0.0 107.829 167.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.63 -30.55 8.06 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -169.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.535 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 98.5 m95 -78.48 144.98 35.25 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.976 1.388 . . . . 0.0 112.058 169.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 162.99 34.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.041 1.336 . . . . 0.0 111.622 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.2 tmpt? -74.65 131.5 40.95 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.431 0.692 . . . . 0.0 111.473 -177.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -128.27 156.09 43.56 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.298 1.439 . . . . 0.0 110.325 -173.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 14.6 ttt -135.32 143.69 46.31 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.086 0.555 . . . . 0.0 111.462 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -90.38 108.75 19.97 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 147.27 1.06 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.484 1.114 . . . . 0.0 110.918 169.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m 65.0 -5.91 0.37 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -136.15 -17.32 1.6 Allowed 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.362 1.892 . . . . 0.0 114.754 169.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.16 10.15 84.19 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.788 1.185 . . . . 0.0 114.46 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 m -62.57 162.18 10.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.268 1.034 . . . . 0.0 109.68 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.9 t -128.42 149.01 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.551 1.54 . . . . 0.0 108.342 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -155.3 -163.28 1.5 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.094 2.157 . . . . 0.0 108.17 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.545 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 10.7 m-85 -134.17 151.86 51.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 109.025 177.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -134.85 132.56 38.75 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.222 1.409 . . . . 0.0 109.836 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -86.03 97.88 10.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 122.7 0.4 . . . . 0.0 110.027 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -71.7 -9.4 58.21 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 28.1 mt -84.73 -35.25 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 124.443 1.097 . . . . 0.0 111.758 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -112.56 -20.1 11.85 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 85.15 6.29 0.49 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 131.039 3.736 . . . . 0.0 114.424 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.49 165.8 16.01 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -139.61 140.71 37.06 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.613 1.565 . . . . 0.0 111.424 173.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -150.79 149.98 30.41 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.822 1.649 . . . . 0.0 107.933 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.24 -32.7 16.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.185 0.902 . . . . 0.0 111.412 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.5 145.25 56.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.084 0.857 . . . . 0.0 110.2 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.06 128.39 49.93 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 125.238 1.415 . . . . 0.0 113.123 -169.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.728 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.1 OUTLIER -60.58 164.62 12.98 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.892 3.061 . . . . 0.0 114.915 169.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 86.2 p 81.84 -91.91 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 129.226 3.01 . . . . 0.0 107.945 -169.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.328 0 C-N-CA 125.923 1.725 . . . . 0.0 114.634 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 tptp . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 117.941 -1.028 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -142.7 164.99 29.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.736 1.214 . . . . 0.0 111.355 -169.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -65.1 159.88 44.56 Favored 'Trans proline' 0 CA--C 1.547 1.163 0 C-N-CA 122.593 2.195 . . . . 0.0 113.33 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.61 117.58 4.34 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.44 2.76 . . . . 0.0 112.024 -170.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.16 -21.0 27.69 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 117.403 -1.776 . . . . 0.0 114.395 177.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -74.48 143.46 44.62 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.226 2.013 . . . . 0.0 113.866 -172.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -149.72 146.32 27.16 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.649 1.179 . . . . 0.0 110.097 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -67.81 144.72 55.22 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.517 0.675 . . . . 0.0 109.939 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -142.85 152.92 42.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.835 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.0 ttm -135.03 137.47 42.99 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.434 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 69.2 m-85 -86.22 100.77 12.47 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.893 1.277 . . . . 0.0 113.545 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.88 146.74 3.08 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.151 0.98 . . . . 0.0 110.394 169.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.2 p 73.13 -9.99 1.07 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.509 2.324 . . . . 0.0 117.036 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -136.22 -21.3 1.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 120.87 1.668 . . . . 0.0 115.239 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.96 5.91 80.15 Favored Glycine 0 CA--C 1.533 1.191 0 CA-C-N 119.312 0.96 . . . . 0.0 114.399 173.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.0 m -61.56 159.55 12.88 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.371 1.069 . . . . 0.0 109.803 172.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -134.41 144.81 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.445 1.498 . . . . 0.0 108.449 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -153.91 -166.69 2.45 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.691 2.396 . . . . 0.0 109.027 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -132.05 151.33 51.82 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.939 0.896 . . . . 0.0 109.966 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -137.39 127.57 26.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.122 1.369 . . . . 0.0 110.012 -172.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -90.78 95.29 10.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.254 0.622 . . . . 0.0 109.565 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -75.11 3.37 8.69 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.293 1.59 . . . . 0.0 115.293 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.8 mt -90.93 -29.85 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 118.864 0.756 . . . . 0.0 111.44 170.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.3 p -112.14 -23.12 10.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.84 1.256 . . . . 0.0 113.787 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 82.9 8.33 0.72 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 130.758 3.623 . . . . 0.0 113.851 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.21 163.05 21.21 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.509 1.049 . . . . 0.0 112.874 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 p -141.61 138.36 32.54 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.029 1.332 . . . . 0.0 110.255 173.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -135.04 148.4 49.89 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.138 172.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.14 -19.94 24.88 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 173.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.1 124.91 25.05 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.068 2.147 . . . . 0.0 107.694 169.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.65 124.01 85.31 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 116.984 -1.484 . . . . 0.0 109.241 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -49.34 -34.47 32.29 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 123.406 2.737 . . . . 0.0 115.211 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.6 p -159.24 29.78 0.2 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.259 1.424 . . . . 0.0 112.621 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.179 0 CA-C-O 118.249 -1.306 . . . . 0.0 113.498 -169.911 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.434 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 87.0 mttt . . . . . 0 N--CA 1.482 1.131 0 CA-C-O 116.909 -1.52 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.671 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.285 0.7 OUTLIER -72.23 165.49 50.22 Favored Pre-proline 0 CA--C 1.565 1.528 0 CA-C-N 120.21 1.368 . . . . 0.0 112.536 178.634 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 87.8 Cg_exo -66.18 162.32 36.33 Favored 'Trans proline' 0 CA--C 1.547 1.133 1 C-N-CA 126.929 5.086 . . . . 0.0 120.091 -169.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -53.62 140.43 65.67 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.597 2.864 . . . . 0.0 107.667 168.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.56 -36.84 4.03 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 117.408 -1.773 . . . . 0.0 110.297 -169.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.552 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.6 m95 -70.36 139.33 51.93 Favored 'General case' 0 C--N 1.352 0.703 0 CA-C-N 120.262 2.031 . . . . 0.0 113.255 169.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -150.2 143.48 25.02 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.906 1.282 . . . . 0.0 110.989 -173.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -66.2 138.94 58.04 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.516 -0.74 . . . . 0.0 111.71 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.55 154.6 47.67 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.151 1.38 . . . . 0.0 110.626 -169.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 33.8 ttp -135.11 130.25 35.18 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.844 0.858 . . . . 0.0 112.061 -173.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -76.72 97.56 4.51 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.054 1.742 . . . . 0.0 112.666 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -58.95 141.33 54.0 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 169.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 59.1 p 89.43 -14.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 129.497 3.119 . . . . 0.0 115.031 -174.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -137.42 -16.56 1.37 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.23 89.32 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.175 0.898 . . . . 0.0 114.248 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 98.9 m -64.07 160.44 18.12 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.534 1.167 . . . . 0.0 110.241 172.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 t -131.27 147.76 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 126.003 1.721 . . . . 0.0 108.775 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -157.64 -166.06 1.92 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.603 1.961 . . . . 0.0 109.03 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.438 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 5.3 m-85 -132.05 150.54 52.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.188 1.395 . . . . 0.0 108.723 175.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -137.76 128.26 26.54 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.705 1.202 . . . . 0.0 109.249 -172.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -86.59 96.91 10.26 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -73.92 -3.96 32.15 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mt -89.58 -33.34 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 124.514 1.126 . . . . 0.0 111.609 172.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.4 p -109.42 -20.94 12.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 85.02 5.42 0.54 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 131.44 3.896 . . . . 0.0 114.376 -172.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.41 163.86 19.92 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.7 p -137.76 141.06 40.95 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.519 1.528 . . . . 0.0 111.09 171.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -148.45 147.69 29.43 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.325 1.85 . . . . 0.0 107.359 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -89.16 -28.78 19.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.158 0.89 . . . . 0.0 110.808 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 144.94 53.4 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.739 0.78 . . . . 0.0 109.983 169.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.67 109.07 31.83 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 126.694 1.998 . . . . 0.0 114.73 -171.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.671 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.3 OUTLIER -48.7 -28.17 12.16 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.373 2.715 . . . . 0.0 116.376 169.722 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.8 m -57.61 -23.02 48.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.658 1.583 . . . . 0.0 115.117 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.187 0 CA-C-N 119.627 1.103 . . . . 0.0 112.894 -178.681 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm . . . . . 0 N--CA 1.482 1.17 0 CA-C-O 118.325 -0.845 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.611 HD13 ' HG3' ' A' ' 32' ' ' PRO 0.287 0.7 OUTLIER -79.68 165.56 46.89 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.859 1.263 . . . . 0.0 113.706 -169.893 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.52 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 85.9 Cg_exo -67.5 163.21 35.69 Favored 'Trans proline' 0 CA--C 1.546 1.101 1 C-N-CA 126.705 4.937 . . . . 0.0 120.309 -169.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.34 140.52 62.68 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 123.637 2.891 . . . . 0.0 107.603 168.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.58 -36.62 4.15 Favored Glycine 0 CA--C 1.526 0.72 0 CA-C-O 117.449 -1.75 . . . . 0.0 110.45 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.584 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 93.0 m95 -71.79 140.96 49.68 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 120.249 2.025 . . . . 0.0 112.975 169.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -149.37 148.38 29.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.354 1.462 . . . . 0.0 110.439 -174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -65.73 144.87 56.62 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.97 0.804 . . . . 0.0 111.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -145.97 153.59 40.96 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.546 0.739 . . . . 0.0 110.443 -171.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 41.5 ttm -130.98 132.76 45.24 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.642 0.777 . . . . 0.0 110.786 -176.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.458 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 60.0 m-85 -76.61 106.7 8.42 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.781 1.632 . . . . 0.0 113.007 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.437 ' NE ' ' H ' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -53.95 146.8 13.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.578 169.893 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.3 p 73.82 -9.14 1.27 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.208 2.203 . . . . 0.0 116.805 -175.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.71 -20.88 0.91 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 169.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.44 4.55 80.27 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-N 119.652 1.114 . . . . 0.0 114.543 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 m -59.68 160.04 7.85 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.612 1.165 . . . . 0.0 109.899 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -129.73 147.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 125.237 1.415 . . . . 0.0 108.779 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -159.05 -168.16 2.29 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.191 1.796 . . . . 0.0 109.294 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.453 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 6.6 m-85 -129.0 149.28 50.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.699 1.199 . . . . 0.0 108.843 174.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -139.02 126.1 21.21 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.361 1.464 . . . . 0.0 109.314 -169.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -85.85 93.58 8.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -72.55 0.5 10.27 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.8 mt -89.56 -25.91 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.14 0.976 . . . . 0.0 111.428 173.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.7 p -120.09 -23.92 6.17 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.463 1.505 . . . . 0.0 114.485 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 85.08 7.41 0.45 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 131.371 3.869 . . . . 0.0 114.544 -170.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.06 164.14 15.99 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.705 1.139 . . . . 0.0 113.544 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.9 p -141.4 142.67 33.72 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.088 1.355 . . . . 0.0 111.85 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -149.65 146.54 27.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.585 1.554 . . . . 0.0 107.985 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -84.6 -28.28 26.65 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.394 0.997 . . . . 0.0 112.465 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.09 148.01 40.11 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.219 0.918 . . . . 0.0 110.617 169.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.0 126.76 56.2 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 125.053 1.341 . . . . 0.0 114.057 -169.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HG3' HD13 ' A' ' 2' ' ' LEU . 0.2 OUTLIER -64.4 -29.55 62.77 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.392 2.061 . . . . 0.0 113.869 168.705 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.0 p -69.42 81.69 0.39 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.307 1.443 . . . . 0.0 110.073 170.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 C-N-CA 126.923 2.202 . . . . 0.0 111.896 -174.388 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.458 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.6 tppm? . . . . . 0 N--CA 1.487 1.381 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.734 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 1.8 mp -148.56 165.97 16.7 Favored Pre-proline 0 CA--C 1.566 1.575 0 C-N-CA 129.753 3.221 . . . . 0.0 107.514 170.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.491 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 83.5 Cg_exo -60.91 165.04 12.73 Favored 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 127.931 5.754 . . . . 0.0 121.017 -171.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.82 140.35 67.82 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.506 2.804 . . . . 0.0 108.248 168.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.44 -36.8 4.06 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 118.102 -1.388 . . . . 0.0 110.253 -169.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.545 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 93.1 m95 -72.65 141.42 48.28 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 120.149 1.974 . . . . 0.0 113.889 169.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -151.04 152.61 33.72 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.987 1.315 . . . . 0.0 110.182 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 136.68 57.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.72 2.008 . . . . 0.0 112.266 -172.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 tpp180 -135.24 152.32 51.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.421 1.088 . . . . 0.0 110.348 -174.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 13.7 ttt -135.23 130.53 35.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.127 0.571 . . . . 0.0 111.701 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CE2' ' CD1' ' A' ' 18' ' ' TYR . 67.6 m-85 -79.38 95.02 5.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.724 1.209 . . . . 0.0 113.596 -176.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -58.31 141.41 51.11 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 90.45 -13.33 0.28 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 129.427 3.091 . . . . 0.0 114.954 -169.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -143.36 -21.35 0.61 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.982 1.719 . . . . 0.0 115.411 169.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.52 77.56 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 125.215 1.388 . . . . 0.0 114.754 175.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 m -59.71 162.08 5.59 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.555 1.142 . . . . 0.0 109.982 171.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.8 t -129.8 148.54 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 125.586 1.554 . . . . 0.0 108.084 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 8.1 p90 -155.97 -163.47 1.49 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.35 2.26 . . . . 0.0 108.126 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.472 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 8.9 m-85 -136.51 153.22 51.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.719 1.208 . . . . 0.0 109.388 177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -140.87 127.33 19.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.722 1.209 . . . . 0.0 109.514 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 14.8 t-20 -79.99 98.45 7.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -69.98 -10.18 57.74 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.1 mt -87.06 -35.5 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.593 1.157 . . . . 0.0 111.729 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.3 p -110.17 -21.98 12.0 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 85.01 7.33 0.46 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 130.836 3.654 . . . . 0.0 114.091 -172.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.67 163.57 18.74 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.27 0.941 . . . . 0.0 113.35 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.5 p -135.95 144.44 45.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.283 1.433 . . . . 0.0 111.516 174.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -144.92 154.46 42.62 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.856 1.662 . . . . 0.0 107.597 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -90.1 -19.92 23.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.671 0.669 . . . . 0.0 110.099 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.61 144.47 57.19 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 169.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.88 105.14 11.1 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.27 2.228 . . . . 0.0 114.153 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.734 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.1 OUTLIER -52.93 -34.98 69.12 Favored 'Trans proline' 0 C--N 1.344 0.328 0 N-CA-C 117.584 2.109 . . . . 0.0 117.584 169.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.9 m -54.38 -48.36 71.61 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.542 1.137 . . . . 0.0 113.205 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.366 -1.796 . . . . 0.0 112.508 -176.525 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.583 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.282 0.9 OUTLIER -127.9 166.01 26.53 Favored Pre-proline 0 CA--C 1.569 1.686 0 C-N-CA 125.33 1.452 . . . . 0.0 113.075 -177.32 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.49 ' CD ' ' HB3' ' A' ' 2' ' ' LEU 0.253 83.3 Cg_exo -67.47 170.73 13.02 Favored 'Trans proline' 0 CA--C 1.555 1.565 1 C-N-CA 129.359 6.706 . . . . 0.0 122.234 -173.355 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.61 140.6 83.88 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 123.773 2.982 . . . . 0.0 107.205 167.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.57 -34.86 5.14 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 109.931 -1.268 . . . . 0.0 109.931 -168.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.407 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 98.4 m95 -76.8 139.93 40.54 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 118.947 1.373 . . . . 0.0 112.51 169.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.99 142.76 30.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.383 1.473 . . . . 0.0 111.189 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -62.91 144.51 56.67 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 122.068 0.937 . . . . 0.0 111.811 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -146.65 153.37 40.23 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.022 0.929 . . . . 0.0 110.063 -169.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 35.2 ttm -133.42 129.81 37.83 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.106 0.562 . . . . 0.0 111.923 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.3 96.31 2.8 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.782 1.633 . . . . 0.0 111.478 173.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt-85 -59.75 155.58 15.7 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.046 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.1 t 65.84 -4.87 0.57 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -136.24 -20.3 1.43 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 121.376 1.898 . . . . 0.0 114.299 169.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.83 3.18 88.2 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.626 1.108 . . . . 0.0 114.157 172.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 93.2 m -65.87 158.38 28.08 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.364 1.082 . . . . 0.0 109.988 173.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.6 t -135.0 142.71 39.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.914 1.686 . . . . 0.0 108.269 -173.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -154.11 -166.05 2.26 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 127.156 2.182 . . . . 0.0 108.738 -172.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.9 m-85 -131.47 151.94 51.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.439 1.096 . . . . 0.0 110.394 176.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -137.97 127.27 24.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.446 1.498 . . . . 0.0 109.23 -173.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -86.55 94.38 9.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -74.02 0.6 13.14 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.93 -27.68 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.037 0.935 . . . . 0.0 111.286 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.8 p -120.06 -24.29 6.08 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.899 1.68 . . . . 0.0 114.864 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 85.22 8.33 0.4 Allowed 'General case' 0 CA--C 1.549 0.935 1 C-N-CA 131.711 4.004 . . . . 0.0 114.685 -169.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.54 167.18 13.38 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 119.815 1.189 . . . . 0.0 114.043 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.8 p -140.18 143.53 36.14 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.937 1.695 . . . . 0.0 111.318 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 155.14 43.96 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.129 1.371 . . . . 0.0 107.799 171.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -90.03 -19.95 23.81 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.945 175.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -71.59 151.94 43.35 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.127 1.33 . . . . 0.0 109.309 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.02 99.85 2.49 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.583 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -45.29 -32.09 7.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.56 3.507 . . . . 0.0 116.686 169.159 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.5 t -132.42 19.01 4.36 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.474 0 C-N-CA 124.11 0.862 . . . . 0.0 114.638 -176.044 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.8 mttp . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.448 ' CB ' ' HB3' ' A' ' 32' ' ' PRO . 1.3 mp -65.65 163.28 35.94 Favored Pre-proline 0 C--O 1.235 0.334 0 C-N-CA 127.009 2.124 . . . . 0.0 111.685 170.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -55.18 159.02 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 121.208 1.272 . . . . 0.0 115.015 -169.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.01 122.34 9.65 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.398 2.066 . . . . 0.0 109.357 -169.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.47 -15.61 29.69 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 115.595 -2.781 . . . . 0.0 116.789 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.488 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 60.9 m95 -68.84 131.44 45.13 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 123.215 3.508 . . . . 0.0 115.174 -174.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -152.37 148.75 27.86 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.354 1.062 . . . . 0.0 112.027 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 128.2 34.93 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.594 2.358 . . . . 0.0 112.164 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.59 156.28 46.04 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.189 1.395 . . . . 0.0 109.56 -170.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.9 ttm -135.06 142.21 46.27 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.237 0.615 . . . . 0.0 111.256 -172.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.495 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 75.1 m-85 -89.63 99.79 12.72 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.859 1.263 . . . . 0.0 113.373 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.28 147.64 2.2 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.128 0.971 . . . . 0.0 110.728 169.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.3 p 72.31 -10.5 0.9 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 127.489 2.315 . . . . 0.0 116.945 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -134.71 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.961 1.709 . . . . 0.0 114.945 169.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.67 5.94 80.91 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 119.055 0.843 . . . . 0.0 114.257 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 m -61.02 158.83 12.66 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.157 0.983 . . . . 0.0 109.682 172.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 t -132.53 148.26 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.58 1.552 . . . . 0.0 108.278 -177.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 6.8 p90 -157.4 -165.09 1.71 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.709 2.004 . . . . 0.0 108.245 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -130.84 154.07 48.43 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.522 1.129 . . . . 0.0 110.384 173.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.87 130.59 27.6 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.991 -1.459 . . . . 0.0 109.068 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -85.02 95.29 9.04 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -69.32 -0.21 5.93 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 10.0 mt -100.48 -27.2 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.428 1.091 . . . . 0.0 111.776 177.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -112.19 -24.45 9.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.142 1.377 . . . . 0.0 113.85 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 83.84 8.28 0.58 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 130.143 3.377 . . . . 0.0 113.707 -169.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.35 165.62 11.49 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.504 1.047 . . . . 0.0 112.741 176.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 p -139.52 154.02 47.59 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.946 1.299 . . . . 0.0 110.448 174.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -149.93 151.31 33.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.306 1.442 . . . . 0.0 107.805 169.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -87.01 -19.63 28.4 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.476 0.58 . . . . 0.0 109.724 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.22 128.5 35.87 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 168.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.89 99.85 2.45 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 -169.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.488 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -52.2 120.24 7.0 Favored 'Trans proline' 0 C--N 1.356 0.932 0 CA-C-N 122.412 1.897 . . . . 0.0 115.462 169.209 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.3 m -76.99 51.27 0.79 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.145 1.778 . . . . 0.0 112.432 172.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 C-N-CA 127.311 2.386 . . . . 0.0 115.303 177.727 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.495 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.26 4.0 mtmp? . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 117.009 -1.472 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.685 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -62.77 165.47 9.67 Favored Pre-proline 0 CA--C 1.564 1.512 0 CA-C-N 120.485 1.493 . . . . 0.0 114.019 -169.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.527 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 92.1 Cg_exo -66.52 165.89 23.65 Favored 'Trans proline' 0 CA--C 1.548 1.197 1 C-N-CA 127.562 5.508 . . . . 0.0 121.392 -170.64 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.3 140.5 62.31 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 123.987 3.125 . . . . 0.0 108.062 168.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.54 -43.75 1.65 Allowed Glycine 0 CA--C 1.527 0.81 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -168.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.479 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 96.0 m95 -70.27 127.37 32.56 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.434 1.617 . . . . 0.0 111.18 169.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -147.0 150.61 35.48 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.218 1.007 . . . . 0.0 111.133 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.79 134.76 42.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.011 2.124 . . . . 0.0 112.88 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -135.77 152.78 51.46 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.202 1.401 . . . . 0.0 109.531 -178.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.7 ttt -135.17 129.74 34.27 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.018 0.527 . . . . 0.0 111.915 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.579 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 44.9 m-85 -81.03 119.04 23.02 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -169.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -55.95 150.95 12.52 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.115 -1.402 . . . . 0.0 110.365 171.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 m 67.26 -3.75 0.97 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -147.17 -21.09 0.4 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 121.751 2.069 . . . . 0.0 116.468 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 87.42 6.78 77.16 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 119.867 1.212 . . . . 0.0 115.169 177.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 50.6 m -54.9 158.76 2.59 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.438 1.495 . . . . 0.0 109.519 170.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.16 148.47 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 125.122 1.369 . . . . 0.0 108.931 -176.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.6 p90 -156.88 -169.51 3.0 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.577 1.551 . . . . 0.0 109.166 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -125.83 149.14 48.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 122.503 1.144 . . . . 0.0 109.054 172.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -139.0 124.38 19.28 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.829 1.652 . . . . 0.0 108.139 -172.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -75.73 99.35 4.35 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.995 174.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -68.86 -9.72 53.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.8 mt -94.09 -31.14 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.756 1.622 . . . . 0.0 112.01 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -116.5 -11.1 11.15 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 68.58 10.67 8.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.125 2.97 . . . . 0.0 115.279 -172.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.68 160.88 13.3 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.006 0.821 . . . . 0.0 112.927 170.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 p -143.44 146.21 33.26 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.925 1.29 . . . . 0.0 111.447 175.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.499 HE22 ' CD2' ' A' ' 2' ' ' LEU . 17.6 tt0 -158.2 138.7 12.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.095 1.358 . . . . 0.0 109.005 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -82.77 -19.7 37.29 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.187 -0.946 . . . . 0.0 112.114 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -77.92 142.01 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.55 110.67 42.8 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -169.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.685 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -57.53 179.15 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 124.393 3.395 . . . . 0.0 115.831 168.615 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 97.6 p 70.02 -80.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 127.278 2.231 . . . . 0.0 111.191 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 C-N-CA 125.727 1.632 . . . . 0.0 113.028 178.545 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.579 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 mtmm . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.557 ' HB2' ' HG3' ' A' ' 32' ' ' PRO . 0.6 OUTLIER -73.07 165.31 53.86 Favored Pre-proline 0 CA--C 1.557 1.228 0 CA-C-N 119.685 1.13 . . . . 0.0 111.353 176.645 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.53 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 80.1 Cg_exo -60.75 159.94 26.77 Favored 'Trans proline' 0 CA--C 1.541 0.856 1 C-N-CA 126.559 4.84 . . . . 0.0 119.422 -169.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -57.17 140.58 93.2 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.17 2.58 . . . . 0.0 106.382 168.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.8 -36.41 4.25 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 116.823 -2.098 . . . . 0.0 110.161 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.58 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 88.4 m95 -69.98 135.68 49.66 Favored 'General case' 0 C--N 1.353 0.728 0 CA-C-N 121.53 2.665 . . . . 0.0 112.89 169.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -151.61 152.5 32.95 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.395 1.078 . . . . 0.0 110.542 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 135.55 57.28 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.613 1.965 . . . . 0.0 112.706 -175.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -136.93 156.75 48.06 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.955 1.302 . . . . 0.0 110.168 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.0 ttt -135.09 139.03 44.38 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.345 0.658 . . . . 0.0 111.203 -173.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.403 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 62.3 m-85 -86.52 103.01 14.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.564 1.146 . . . . 0.0 113.418 -178.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.05 134.63 52.7 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.182 169.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 t 90.19 -7.83 0.35 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 128.699 2.8 . . . . 0.0 115.743 -178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -141.71 -15.43 0.82 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.41 1.459 . . . . 0.0 114.224 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.73 11.19 83.35 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.383 0.992 . . . . 0.0 114.236 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 51.8 m -64.46 163.61 13.02 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.358 1.079 . . . . 0.0 110.205 170.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.2 t -130.49 149.77 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 125.707 1.603 . . . . 0.0 108.658 -175.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 5.5 p90 -156.26 -168.23 2.67 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.615 1.966 . . . . 0.0 109.091 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.416 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 3.8 m-85 -128.63 149.66 50.56 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.755 1.222 . . . . 0.0 108.519 173.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -139.22 126.85 21.84 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.272 1.429 . . . . 0.0 108.899 -170.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -78.92 97.63 6.09 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 123.592 0.558 . . . . 0.0 109.713 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -68.89 -7.78 37.88 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.1 mt -92.98 -33.41 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 125.355 1.462 . . . . 0.0 111.76 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.9 p -111.47 -22.31 11.34 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 85.11 6.93 0.46 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 130.913 3.685 . . . . 0.0 114.325 -172.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.05 161.78 20.91 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.519 1.054 . . . . 0.0 113.498 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.8 p -136.94 140.98 42.64 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.111 1.364 . . . . 0.0 112.08 174.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -147.15 141.62 26.46 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.114 1.766 . . . . 0.0 107.873 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -81.14 -28.54 35.03 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.507 1.049 . . . . 0.0 112.629 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.14 150.44 37.19 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.08 0.854 . . . . 0.0 110.581 169.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.26 111.31 46.33 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 127.463 2.305 . . . . 0.0 113.563 -169.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.58 ' HG2' ' CG ' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -53.73 -28.07 45.54 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.269 1.979 . . . . 0.0 116.692 169.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 63.0 p -63.99 -12.59 39.29 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.694 1.738 . . . . 0.0 115.694 -174.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.103 0 CA-C-O 118.421 -1.211 . . . . 0.0 112.948 176.696 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.403 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 1' ' ' LYS . 13.9 tptp . . . . . 0 N--CA 1.476 0.832 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.366 2.1 mm? -62.52 165.72 8.67 Favored Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 124.62 1.168 . . . . 0.0 111.693 169.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.1 159.32 4.14 Favored 'Trans proline' 0 C--N 1.353 0.786 0 N-CA-C 118.115 2.313 . . . . 0.0 118.115 -167.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -50.09 119.1 4.49 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 123.961 3.107 . . . . 0.0 111.72 -169.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.32 -28.65 10.0 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 115.044 -3.087 . . . . 0.0 117.418 -175.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -67.67 121.32 15.66 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 124.134 3.967 . . . . 0.0 115.998 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 8' ' ' LYS . 12.0 tp10 -165.05 163.12 20.65 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.878 2.071 . . . . 0.0 110.742 169.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.52 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.6 ttpm? -49.74 145.63 5.08 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 130.55 3.54 . . . . 0.0 114.521 177.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -141.72 159.57 41.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.397 1.879 . . . . 0.0 109.031 171.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 34.4 ttp -131.94 140.34 48.98 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.338 1.055 . . . . 0.0 110.557 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.455 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 75.4 m-85 -87.27 95.9 10.15 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.829 1.252 . . . . 0.0 113.351 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.33 146.45 28.87 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 169.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.2 p 90.32 -16.82 0.21 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 130.111 3.364 . . . . 0.0 115.098 -169.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -144.23 -19.56 0.56 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.967 1.84 . . . . 0.0 115.967 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.88 6.99 71.47 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-N 119.939 1.245 . . . . 0.0 114.712 178.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.2 m -58.35 158.04 7.86 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 0.0 109.61 170.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.1 t -134.61 148.87 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 C-N-CA 125.716 1.606 . . . . 0.0 108.528 -175.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.429 ' CD1' ' CE2' ' A' ' 11' ' ' PHE . 10.5 p90 -156.16 -176.47 5.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.611 1.564 . . . . 0.0 109.277 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -123.73 141.39 52.07 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.9 1.333 . . . . 0.0 108.617 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -133.59 136.63 45.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 113.518 -1.674 . . . . 0.0 108.925 -169.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -86.16 92.29 8.7 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 169.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -65.99 2.0 1.25 Allowed 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mp -105.12 -47.55 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.63 1.172 . . . . 0.0 110.969 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.7 p -85.65 -28.85 24.48 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.539 1.135 . . . . 0.0 113.523 176.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 85.02 11.97 0.27 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 130.337 3.455 . . . . 0.0 115.019 -172.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.74 19.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.29 0.95 . . . . 0.0 112.322 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.5 p -145.09 136.38 25.05 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.538 1.135 . . . . 0.0 111.506 176.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -135.15 159.43 41.56 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -84.44 -22.49 30.33 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.745 -1.222 . . . . 0.0 109.338 170.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.24 124.48 24.24 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.712 2.005 . . . . 0.0 109.821 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.2 126.11 57.99 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 127.211 2.204 . . . . 0.0 110.646 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -64.14 160.27 39.05 Favored 'Trans proline' 0 CA--C 1.551 1.338 0 CA-C-N 122.63 1.975 . . . . 0.0 109.858 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.4 m -74.83 58.99 0.86 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.493 0 C-N-CA 126.784 2.135 . . . . 0.0 114.241 176.189 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.455 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.583 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.25 1.7 mp -77.74 165.2 52.82 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 169.172 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 88.5 Cg_exo -60.42 159.94 25.5 Favored 'Trans proline' 0 CA--C 1.541 0.835 1 C-N-CA 126.453 4.769 . . . . 0.0 119.38 -169.56 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -59.59 140.57 94.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.177 2.585 . . . . 0.0 105.698 168.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.74 -35.22 4.92 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-O 116.393 -2.337 . . . . 0.0 110.514 -168.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.501 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 89.6 m95 -70.55 137.66 50.3 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-N 121.295 2.547 . . . . 0.0 112.638 169.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -146.09 141.89 28.0 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.438 1.495 . . . . 0.0 110.555 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -66.32 138.76 57.85 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 121.65 -0.656 . . . . 0.0 111.512 -174.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.4 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -138.67 154.29 48.61 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.279 1.432 . . . . 0.0 109.906 -169.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 22.5 ttp -134.14 137.33 44.44 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.63 0.772 . . . . 0.0 111.183 -172.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.403 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 71.4 m-85 -82.27 102.14 10.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.662 1.185 . . . . 0.0 112.19 175.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -54.16 152.57 5.95 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.306 169.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.6 t 65.5 -4.1 0.61 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -173.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -138.87 -18.87 1.03 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.553 1.978 . . . . 0.0 114.95 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.33 6.54 89.21 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.09 0.852 . . . . 0.0 114.305 173.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.0 m -65.58 160.98 21.26 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.345 1.072 . . . . 0.0 110.197 171.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -134.3 147.31 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 125.868 1.667 . . . . 0.0 109.078 -173.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -156.61 -166.62 2.17 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.658 1.983 . . . . 0.0 108.968 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.419 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 3.9 m-85 -131.44 150.92 51.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.432 1.093 . . . . 0.0 109.256 175.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -133.46 128.3 35.14 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 108.897 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -89.59 96.5 10.73 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 30.6 p80 -74.63 -1.42 21.58 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.8 mt -92.41 -34.04 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 124.571 1.148 . . . . 0.0 111.547 172.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.2 p -105.55 -21.69 13.15 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 85.06 6.55 0.48 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 131.407 3.883 . . . . 0.0 114.12 -172.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.99 165.13 20.78 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.5 p -140.32 138.94 35.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.632 1.573 . . . . 0.0 110.257 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -150.0 147.21 27.57 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.42 1.488 . . . . 0.0 108.38 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -90.09 -30.99 17.32 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.634 1.106 . . . . 0.0 110.666 -175.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.72 124.89 21.95 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.707 2.003 . . . . 0.0 108.227 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? -90.11 113.24 56.52 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.087 1.355 . . . . 0.0 113.188 -169.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.588 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 30.1 Cg_exo -52.92 -33.54 62.35 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 123.082 2.522 . . . . 0.0 116.993 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.4 m -156.73 63.8 0.52 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.329 0.652 . . . . 0.0 112.187 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.258 0 CA-C-O 117.965 -1.464 . . . . 0.0 113.192 173.867 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.403 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 117.446 -1.264 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.352 0.3 OUTLIER -66.43 165.49 23.47 Favored Pre-proline 0 CA--C 1.562 1.437 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -169.53 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.479 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 77.6 Cg_exo -74.98 167.46 27.0 Favored 'Trans proline' 0 CA--C 1.55 1.284 1 C-N-CA 127.081 5.188 . . . . 0.0 121.167 -171.445 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -54.17 140.59 71.26 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 123.827 3.018 . . . . 0.0 107.467 167.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.68 -35.86 4.57 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.977 -168.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.577 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 97.0 m95 -73.48 141.88 46.81 Favored 'General case' 0 C--N 1.348 0.535 0 CA-C-N 120.237 2.019 . . . . 0.0 112.136 169.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -150.72 154.56 37.63 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.828 1.251 . . . . 0.0 110.174 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.72 145.0 46.6 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.231 1.413 . . . . 0.0 111.861 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.5 155.29 43.01 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.18 -0.95 . . . . 0.0 110.67 -178.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.3 ttt -135.23 142.68 46.04 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.234 0.614 . . . . 0.0 111.365 -172.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.473 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 67.6 m-85 -95.29 98.12 10.36 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.572 1.149 . . . . 0.0 113.754 -177.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.3 146.62 18.78 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.901 169.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 p 90.04 -19.83 0.16 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 129.67 3.188 . . . . 0.0 114.806 -170.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -141.88 -20.31 0.73 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.48 10.27 77.34 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-N 119.385 0.993 . . . . 0.0 114.727 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.2 m -58.07 160.49 4.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.718 1.207 . . . . 0.0 109.8 170.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.67 149.86 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.575 1.55 . . . . 0.0 108.527 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -155.79 -168.09 2.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.58 1.952 . . . . 0.0 109.745 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.404 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 5.4 m-85 -131.35 149.17 52.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.058 1.343 . . . . 0.0 108.961 174.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -137.1 127.44 26.48 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.073 1.749 . . . . 0.0 109.395 -171.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' TRP . 13.5 t-20 -80.21 99.41 7.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.133 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -72.03 -5.98 39.02 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.2 mt -93.61 -33.35 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.071 1.348 . . . . 0.0 111.723 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.5 p -111.29 -22.42 11.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 85.08 7.52 0.44 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.84 3.656 . . . . 0.0 114.452 -173.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.26 163.27 18.3 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 119.361 0.982 . . . . 0.0 113.568 176.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.6 p -144.96 137.89 26.45 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.914 1.285 . . . . 0.0 112.268 175.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.86 160.13 44.09 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.818 1.247 . . . . 0.0 109.818 169.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -87.94 -27.15 22.3 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -169.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.89 158.54 23.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.77 1.168 . . . . 0.0 111.449 172.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.0 137.31 28.19 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -170.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.588 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -70.6 -175.13 1.25 Allowed 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 124.49 3.46 . . . . 0.0 114.745 168.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.3 m 62.93 -66.99 0.09 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.842 2.057 . . . . 0.0 112.405 -171.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.297 0 C-N-CA 125.917 1.722 . . . . 0.0 112.042 173.14 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.473 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.411 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.696 ' HB2' ' HG3' ' A' ' 32' ' ' PRO 0.29 1.6 mp -142.05 165.76 25.64 Favored Pre-proline 0 CA--C 1.563 1.455 0 O-C-N 120.733 -1.23 . . . . 0.0 111.664 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.553 ' CD ' ' HB3' ' A' ' 2' ' ' LEU . 89.7 Cg_exo -60.21 163.7 14.05 Favored 'Trans proline' 0 CA--C 1.546 1.108 1 C-N-CA 127.359 5.373 . . . . 0.0 120.228 -171.197 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -57.49 140.59 93.71 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 123.3 2.667 . . . . 0.0 106.959 168.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.68 -34.88 5.12 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.545 -1.697 . . . . 0.0 109.886 -168.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CG ' ' HG2' ' A' ' 32' ' ' PRO . 92.7 m95 -73.03 142.32 47.68 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.663 2.231 . . . . 0.0 112.577 169.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -148.28 153.5 38.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.264 1.426 . . . . 0.0 109.829 178.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.89 145.27 36.06 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.431 1.492 . . . . 0.0 111.608 -179.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.47 152.45 39.8 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.802 -1.186 . . . . 0.0 110.286 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.6 ttt -135.26 137.01 42.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.791 0.436 . . . . 0.0 111.929 -172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.44 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 77.1 m-85 -86.83 95.03 9.72 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 125.446 1.499 . . . . 0.0 112.869 178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 144.24 42.25 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.2 p 89.98 -16.24 0.24 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.773 3.229 . . . . 0.0 115.061 -171.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -138.81 -20.47 1.0 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 169.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.8 7.15 78.73 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.294 1.426 . . . . 0.0 114.719 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 41.9 m -60.11 160.16 8.56 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.565 1.146 . . . . 0.0 109.947 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 35.4 t -131.09 149.41 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 125.631 1.573 . . . . 0.0 107.994 -176.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.75 -168.53 2.93 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.731 2.012 . . . . 0.0 108.577 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.466 ' CD2' ' HD2' ' A' ' 32' ' ' PRO . 7.5 m-85 -131.14 153.02 49.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 122.113 0.958 . . . . 0.0 108.779 172.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -135.08 128.56 32.45 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.757 2.023 . . . . 0.0 109.156 -172.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -84.09 100.13 10.92 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -71.92 -3.95 25.48 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.9 mt -98.17 -32.34 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 125.387 1.475 . . . . 0.0 111.831 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.7 p -113.48 -13.43 12.81 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 79.23 1.23 2.34 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 129.164 2.986 . . . . 0.0 114.147 -176.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 162.48 9.84 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -140.22 137.51 34.35 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.505 1.522 . . . . 0.0 110.978 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -145.17 144.44 30.87 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.428 1.491 . . . . 0.0 108.207 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -80.64 -19.86 44.41 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.686 -0.634 . . . . 0.0 112.329 -177.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -64.61 154.99 34.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 169.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mtp-105 -90.24 111.7 48.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 125.148 1.379 . . . . 0.0 112.706 171.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.696 ' HG3' ' HB2' ' A' ' 2' ' ' LEU . 0.0 OUTLIER -54.32 -38.94 88.9 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 N-CA-C 116.276 1.606 . . . . 0.0 116.276 169.069 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.9 p -71.9 73.49 0.86 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.357 1.463 . . . . 0.0 111.699 175.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.373 0 C-N-CA 127.305 2.383 . . . . 0.0 112.983 176.791 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.44 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_